Details
Stereochemistry | ACHIRAL |
Molecular Formula | C17H23N3O.C4H4O4 |
Molecular Weight | 401.4562 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.COC1=CC=C(CN(CCN(C)C)C2=CC=CC=N2)C=C1
InChI
InChIKey=JXYWFNAQESKDNC-BTJKTKAUSA-N
InChI=1S/C17H23N3O.C4H4O4/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;5-3(6)1-2-4(7)8/h4-11H,12-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C17H23N3O |
Molecular Weight | 285.384 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:06:58 UTC 2023
by
admin
on
Fri Dec 15 15:06:58 UTC 2023
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Record UNII |
R35D29L3ZA
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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CFR |
21 CFR 522.2063
Created by
admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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CFR |
21 CFR 341.12
Created by
admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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NCI_THESAURUS |
C29578
Created by
admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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Code System | Code | Type | Description | ||
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DBSALT001405
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3604
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DTXSID4021216
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R35D29L3ZA
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5284451
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m9367
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admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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PRIMARY | Merck Index | ||
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82091
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admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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CHEMBL511
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R35D29L3ZA
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200-422-7
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admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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1588004
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100000091887
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SUB14516MIG
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admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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C61915
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admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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59-33-6
Created by
admin on Fri Dec 15 15:06:58 UTC 2023 , Edited by admin on Fri Dec 15 15:06:58 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |