Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H28N2O3.ClH |
| Molecular Weight | 404.93 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@@]12[C@@H](CCOC)C[C@H]3C[N@@]1CCC4=C(NC5=CC=CC=C45)[C@@]2(C3)C(=O)OC
InChI
InChIKey=CVBFKKVQGICEBT-BWXWGAIDSA-N
InChI=1S/C22H28N2O3.ClH/c1-26-10-8-15-11-14-12-22(21(25)27-2)19-17(7-9-24(13-14)20(15)22)16-5-3-4-6-18(16)23-19;/h3-6,14-15,20,23H,7-13H2,1-2H3;1H/t14-,15+,20+,22-;/m1./s1
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C22H28N2O3 |
| Molecular Weight | 368.4693 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:07:18 UTC 2023
by
admin
on
Sat Dec 16 10:07:18 UTC 2023
|
| Record UNII |
85Z0P8329N
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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85Z0P8329N
Created by
admin on Sat Dec 16 10:07:18 UTC 2023 , Edited by admin on Sat Dec 16 10:07:18 UTC 2023
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266686-77-5
Created by
admin on Sat Dec 16 10:07:18 UTC 2023 , Edited by admin on Sat Dec 16 10:07:18 UTC 2023
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76960565
Created by
admin on Sat Dec 16 10:07:18 UTC 2023 , Edited by admin on Sat Dec 16 10:07:18 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
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PARENT -> SALT/SOLVATE |
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