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Details

Stereochemistry ACHIRAL
Molecular Formula C13H19NO4S
Molecular Weight 285.359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXANOIC ACID, 6-(((4-METHYLPHENYL)SULFONYL)AMINO)-

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(O)=O

InChI

InChIKey=GLKZGJGPYOFPKV-UHFFFAOYSA-N
InChI=1S/C13H19NO4S/c1-11-6-8-12(9-7-11)19(17,18)14-10-4-2-3-5-13(15)16/h6-9,14H,2-5,10H2,1H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C13H19NO4S
Molecular Weight 285.359
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 11:25:22 GMT 2023
Edited
by admin
on Sat Dec 16 11:25:22 GMT 2023
Record UNII
MSG7DH58W4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXANOIC ACID, 6-(((4-METHYLPHENYL)SULFONYL)AMINO)-
Systematic Name English
6-(((4-METHYLPHENYL)SULFONYL)AMINO)HEXANOIC ACID
Systematic Name English
NSC-38047
Code English
6-((4-METHYLBENZENESULFONYL)AMINO)CAPROIC ACID
Common Name English
HEXANOIC ACID, 6-P-TOLUENESULFONAMIDO-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID2074374
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
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NSC
38047
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
PRIMARY
CAS
78521-39-8
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
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PUBCHEM
95822
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
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ECHA (EC/EINECS)
278-934-5
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
PRIMARY
FDA UNII
MSG7DH58W4
Created by admin on Sat Dec 16 11:25:22 GMT 2023 , Edited by admin on Sat Dec 16 11:25:22 GMT 2023
PRIMARY