4-cyano-3-(3-cyanophenyl)-4-phenyl-butanoate

Systemtic Name: 4-cyano-3-(3-cyanophenyl)-4-phenyl-butanoate Openeye Name: 4-cyano-3-(3-cyanophenyl)-4-phenyl-butanoate CAS Name: 4-cyano-3-(3-cyanophenyl)-4-phenylbutanoate IUPAC Name: 4-cyano-3-(3-cyanophenyl)-4-phenylbutanoate Traditional Name: 4-cyano-3-(3-cyanophenyl)-4-phenyl-butyrate Formula: C18H13N2O2- MolecularWeight: 289.30802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O2/c19-11-13-5-4-8-15(9-13)16(10-18(21)22)17(12-20)14-6-2-1-3-7-14/h1-9,16-17H,10H2,(H,21,22)/p-1