2-[3-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid Openeye Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoylamino]benzoic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H14ClNO3S/c17-11-5-7-12(8-6-11)22-10-9-15(19)18-14-4-2-1-3-13(14)16(20)21/h1-8H,9-10H2,(H,18,19)(H,20,21)