[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C22H16BrClO3S MolecularWeight: 475.78264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H16BrClO3S/c23-18-7-5-16(6-8-18)21(25)13-27-22(26)17-3-1-15(2-4-17)14-28-20-11-9-19(24)10-12-20/h1-12H,13-14H2