4-cyano-3,4-diphenyl-butanoate

Systemtic Name: 4-cyano-3,4-diphenyl-butanoate Openeye Name: 4-cyano-3,4-diphenyl-butanoate CAS Name: 4-cyano-3,4-diphenylbutanoate IUPAC Name: 4-cyano-3,4-diphenylbutanoate Traditional Name: 4-cyano-3,4-diphenyl-butyrate Formula: C17H14NO2- MolecularWeight: 264.29856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)[O-])C(C#N)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)[O-])C(C#N)C2=CC=CC=C2

InChI

InChI=1S/C17H15NO2/c18-12-16(14-9-5-2-6-10-14)15(11-17(19)20)13-7-3-1-4-8-13/h1-10,15-16H,11H2,(H,19,20)/p-1