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3-[3-[(4-bromophenyl)sulfonylamino]hexanoylamino]benzoic acid

3-[3-[(4-bromophenyl)sulfonylamino]hexanoylamino]benzoic acid

Systemtic Name:3-[3-[(4-bromophenyl)sulfonylamino]hexanoylamino]benzoic acid
Openeye Name:3-[3-[(4-bromophenyl)sulfonylamino]hexanoylamino]benzoic acid
CAS Name:3-[[3-[(4-bromophenyl)sulfonylamino]-1-oxohexyl]amino]benzoic acid
IUPAC Name:3-[3-[(4-bromophenyl)sulfonylamino]hexanoylamino]benzoic acid
Traditional Name:3-[3-(brosylamino)hexanoylamino]benzoic acid
Formula: C19H21BrN2O5S
MolecularWeight: 469.34944
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)NC1=CC=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Br


Isomeric SMILES

CCCC(CC(=O)NC1=CC=CC(=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Br


InChI

InChI=1S/C19H21BrN2O5S/c1-2-4-16(22-28(26,27)17-9-7-14(20)8-10-17)12-18(23)21-15-6-3-5-13(11-15)19(24)25/h3,5-11,16,22H,2,4,12H2,1H3,(H,21,23)(H,24,25)


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