Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H25ClN2O5.C6H6O3S |
| Molecular Weight | 567.051 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(=O)(=O)C1=CC=CC=C1.CCOC(=O)C2=C(COCCN)NC(C)=C([C@H]2C3=CC=CC=C3Cl)C(=O)OC
InChI
InChIKey=ZPBWCRDSRKPIDG-UNTBIKODSA-N
InChI=1S/C20H25ClN2O5.C6H6O3S/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;7-10(8,9)6-4-2-1-3-5-6/h5-8,17,23H,4,9-11,22H2,1-3H3;1-5H,(H,7,8,9)/t17-;/m1./s1
| Molecular Formula | C6H6O3S |
| Molecular Weight | 158.175 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C20H25ClN2O5 |
| Molecular Weight | 408.876 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:30:24 GMT 2025
by
admin
on
Mon Mar 31 23:30:24 GMT 2025
|
| Record UNII |
5K09K116QG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Preferred Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
828247-64-9
Created by
admin on Mon Mar 31 23:30:24 GMT 2025 , Edited by admin on Mon Mar 31 23:30:24 GMT 2025
|
PRIMARY | |||
|
5K09K116QG
Created by
admin on Mon Mar 31 23:30:24 GMT 2025 , Edited by admin on Mon Mar 31 23:30:24 GMT 2025
|
PRIMARY | |||
|
10231529
Created by
admin on Mon Mar 31 23:30:24 GMT 2025 , Edited by admin on Mon Mar 31 23:30:24 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
RACEMATE -> ENANTIOMER |
|