[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-methylsulfanylbenzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C16H13BrO3S MolecularWeight: 365.24162

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSC1=CC=CC=C1C(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H13BrO3S/c1-21-15-5-3-2-4-13(15)16(19)20-10-14(18)11-6-8-12(17)9-7-11/h2-9H,10H2,1H3