Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C11H14NO4S.Na |
| Molecular Weight | 279.288 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC(C)N(C(=O)CS([O-])(=O)=O)C1=CC=CC=C1
InChI
InChIKey=BQFQHQFNSWKXJL-UHFFFAOYSA-M
InChI=1S/C11H15NO4S.Na/c1-9(2)12(10-6-4-3-5-7-10)11(13)8-17(14,15)16;/h3-7,9H,8H2,1-2H3,(H,14,15,16);/q;+1/p-1
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C11H14NO4S |
| Molecular Weight | 256.298 |
| Charge | -1 |
| 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 20:10:33 GMT 2023
by
admin
on
Sat Dec 16 20:10:33 GMT 2023
|
| Record UNII |
NFW5YNE2FJ
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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947601-88-9
Created by
admin on Sat Dec 16 20:10:34 GMT 2023 , Edited by admin on Sat Dec 16 20:10:34 GMT 2023
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NFW5YNE2FJ
Created by
admin on Sat Dec 16 20:10:34 GMT 2023 , Edited by admin on Sat Dec 16 20:10:34 GMT 2023
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23676740
Created by
admin on Sat Dec 16 20:10:34 GMT 2023 , Edited by admin on Sat Dec 16 20:10:34 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of 2-[(1-Methylethyl)phenylamino]-2-oxoethanesulfonic acid](/img/fd9aa428-1e2e-4c32-bc57-6aec1a7c5628.svg "Structure of 2-[(1-Methylethyl)phenylamino]-2-oxoethanesulfonic acid")