[1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-oxo-1,2-bis(p-tolyl)ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1,2-bis(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [1,2-bis(4-methylphenyl)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-1,2-bis(p-tolyl)ethyl] ester Formula: C24H19NO3 MolecularWeight: 369.41256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H19NO3/c1-16-6-10-19(11-7-16)22(26)23(20-12-8-17(2)9-13-20)28-24(27)21-5-3-4-18(14-21)15-25/h3-14,23H,1-2H3