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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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
MSG7DH58W4
Record Status Validated (UNII)
Record Version