3-[4-(3-cyanophenyl)-4-oxidanylidene-butanoyl]benzenecarbonitrile

Systemtic Name: 3-[4-(3-cyanophenyl)-4-oxidanylidene-butanoyl]benzenecarbonitrile Openeye Name: 3-[4-(3-cyanophenyl)-4-oxo-butanoyl]benzonitrile CAS Name: 3-[4-(3-cyanophenyl)-1,4-dioxobutyl]benzonitrile IUPAC Name: 3-[4-(3-cyanophenyl)-4-oxobutanoyl]benzonitrile Traditional Name: 3-[4-(3-cyanophenyl)-4-keto-butanoyl]benzonitrile Formula: C18H12N2O2 MolecularWeight: 288.30008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CCC(=O)C2=CC=CC(=C2)C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CCC(=O)C2=CC=CC(=C2)C#N)C#N

InChI

InChI=1S/C18H12N2O2/c19-11-13-3-1-5-15(9-13)17(21)7-8-18(22)16-6-2-4-14(10-16)12-20/h1-6,9-10H,7-8H2