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

Systemtic Name: 2-[(3-chlorophenyl)methyl-(phenylsulfonyl)amino]benzoic acid Openeye Name: 2-[benzenesulfonyl-[(3-chlorophenyl)methyl]amino]benzoic acid CAS Name: 2-[benzenesulfonyl-[(3-chlorophenyl)methyl]amino]benzoic acid IUPAC Name: 2-[benzenesulfonyl-[(3-chlorophenyl)methyl]amino]benzoic acid Traditional Name: 2-[besyl-(3-chlorobenzyl)amino]benzoic acid Formula: C20H16ClNO4S MolecularWeight: 401.86334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=CC=C2)Cl)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=CC=C2)Cl)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H16ClNO4S/c21-16-8-6-7-15(13-16)14-22(19-12-5-4-11-18(19)20(23)24)27(25,26)17-9-2-1-3-10-17/h1-13H,14H2,(H,23,24)