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

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C16H10BrNO3 MolecularWeight: 344.1595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)OCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)OCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H10BrNO3/c17-14-7-5-12(6-8-14)15(19)10-21-16(20)13-3-1-11(9-18)2-4-13/h1-8H,10H2