Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H11ClN2O5S.C6H15NO |
| Molecular Weight | 447.934 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCN(CC)CCO.NS(=O)(=O)C1=CC(C(O)=O)=C(NCC2=CC=CO2)C=C1Cl
InChI
InChIKey=JTMYQHVUVVWDOK-UHFFFAOYSA-N
InChI=1S/C12H11ClN2O5S.C6H15NO/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19;1-3-7(4-2)5-6-8/h1-5,15H,6H2,(H,16,17)(H2,14,18,19);8H,3-6H2,1-2H3
| Molecular Formula | C12H11ClN2O5S |
| Molecular Weight | 330.744 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C6H15NO |
| Molecular Weight | 117.1894 |
| 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
Sat Dec 16 15:22:53 UTC 2023
by
admin
on
Sat Dec 16 15:22:53 UTC 2023
|
| Record UNII |
0WO571ZA9F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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146019556
Created by
admin on Sat Dec 16 15:22:53 UTC 2023 , Edited by admin on Sat Dec 16 15:22:53 UTC 2023
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PRIMARY | |||
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0WO571ZA9F
Created by
admin on Sat Dec 16 15:22:53 UTC 2023 , Edited by admin on Sat Dec 16 15:22:53 UTC 2023
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PRIMARY | |||
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100000176391
Created by
admin on Sat Dec 16 15:22:53 UTC 2023 , Edited by admin on Sat Dec 16 15:22:53 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |