U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H17NO3S
Molecular Weight 291.365
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-((ETHYLPHENYLAMINO)METHYL)BENZENESULFONIC ACID

SMILES

CCN(CC1=CC=C(C=C1)S(O)(=O)=O)C2=CC=CC=C2

InChI

InChIKey=HSBRAZWXTOKJQF-UHFFFAOYSA-N
InChI=1S/C15H17NO3S/c1-2-16(14-6-4-3-5-7-14)12-13-8-10-15(11-9-13)20(17,18)19/h3-11H,2,12H2,1H3,(H,17,18,19)

HIDE SMILES / InChI

Approval Year

Patents
Name Type Language
4-((ETHYLPHENYLAMINO)METHYL)BENZENESULFONIC ACID
Systematic Name English
P-TOLUENESULFONIC ACID, .ALPHA.-(N-ETHYLANILINO)-
Common Name English
NSC-8644
Code English
.ALPHA.-(N-ETHYLANILINO)-P-TOLUENESULFONIC ACID
Common Name English
BENZENESULFONIC ACID, 4-((ETHYLPHENYLAMINO)METHYL)-
Common Name English
Code System Code Type Description
FDA UNII
Z3DU75V1GX
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY
CAS
92-60-4
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-170-3
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY
NSC
8644
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY
PUBCHEM
66712
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID8059059
Created by admin on Fri Dec 15 18:53:09 GMT 2023 , Edited by admin on Fri Dec 15 18:53:09 GMT 2023
PRIMARY