[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C18H15BrO4S MolecularWeight: 407.2783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrO4S/c1-12(20)11-24-17-5-3-2-4-15(17)18(22)23-10-16(21)13-6-8-14(19)9-7-13/h2-9H,10-11H2,1H3