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

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-methylbenzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C16H13BrO3 MolecularWeight: 333.17662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H13BrO3/c1-11-2-4-13(5-3-11)16(19)20-10-15(18)12-6-8-14(17)9-7-12/h2-9H,10H2,1H3