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

Systemtic Name: 4-chloranyl-3-[2-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid Openeye Name: 4-chloro-3-[2-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid CAS Name: 4-chloro-3-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[2-(4-chlorophenyl)sulfanylpropanoylamino]benzoic acid Traditional Name: 4-chloro-3-[2-[(4-chlorophenyl)thio]propanoylamino]benzoic acid Formula: C16H13Cl2NO3S MolecularWeight: 370.25032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H13Cl2NO3S/c1-9(23-12-5-3-11(17)4-6-12)15(20)19-14-8-10(16(21)22)2-7-13(14)18/h2-9H,1H3,(H,19,20)(H,21,22)