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Details

Stereochemistry ACHIRAL
Molecular Formula C15H17NO6S2
Molecular Weight 371.429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ETHYL-N-(3-SULFOBENZYL)SULFANILIC ACID

SMILES

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

InChI

InChIKey=AYCUIMULGJGRRZ-UHFFFAOYSA-N
InChI=1S/C15H17NO6S2/c1-2-16(13-6-8-14(9-7-13)23(17,18)19)11-12-4-3-5-15(10-12)24(20,21)22/h3-10H,2,11H2,1H3,(H,17,18,19)(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula C15H17NO6S2
Molecular Weight 371.429
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 Sat Dec 16 12:46:52 GMT 2023
Edited
by admin
on Sat Dec 16 12:46:52 GMT 2023
Record UNII
K5IM577XEN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ETHYL-N-(3-SULFOBENZYL)SULFANILIC ACID
Systematic Name English
SULFANILIC ACID, N-ETHYL-N-(M-SULFOBENZYL)-
Systematic Name English
M-TOLUENESULFONIC ACID, .ALPHA.-(N-ETHYL-P-SULFOANILINO)-
Systematic Name English
ESBSA
Common Name English
BENZENESULFONIC ACID, 3-((ETHYL(4-SULFOPHENYL)AMINO)METHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
K5IM577XEN
Created by admin on Sat Dec 16 12:46:52 GMT 2023 , Edited by admin on Sat Dec 16 12:46:52 GMT 2023
PRIMARY
CAS
5363-53-1
Created by admin on Sat Dec 16 12:46:52 GMT 2023 , Edited by admin on Sat Dec 16 12:46:52 GMT 2023
PRIMARY
PUBCHEM
85835801
Created by admin on Sat Dec 16 12:46:52 GMT 2023 , Edited by admin on Sat Dec 16 12:46:52 GMT 2023
PRIMARY