3-[2-[methyl(phenylsulfonyl)amino]propanoylamino]benzoic acid

Systemtic Name: 3-[2-[methyl(phenylsulfonyl)amino]propanoylamino]benzoic acid Openeye Name: 3-[2-[benzenesulfonyl(methyl)amino]propanoylamino]benzoic acid CAS Name: 3-[[2-[benzenesulfonyl(methyl)amino]-1-oxopropyl]amino]benzoic acid IUPAC Name: 3-[2-[benzenesulfonyl(methyl)amino]propanoylamino]benzoic acid Traditional Name: 3-[2-[besyl(methyl)amino]propanoylamino]benzoic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)N(C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)N(C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18N2O5S/c1-12(19(2)25(23,24)15-9-4-3-5-10-15)16(20)18-14-8-6-7-13(11-14)17(21)22/h3-12H,1-2H3,(H,18,20)(H,21,22)