2-[(Z)-2-butyl-3-(3-oxidanylidene-3-phenyl-propyl)-1-phenyl-hept-2-enyl]propanedinitrile

Systemtic Name: 2-[(Z)-2-butyl-3-(3-oxidanylidene-3-phenyl-propyl)-1-phenyl-hept-2-enyl]propanedinitrile Openeye Name: 2-[(Z)-2-butyl-3-(3-oxo-3-phenyl-propyl)-1-phenyl-hept-2-enyl]propanedinitrile CAS Name: 2-[(Z)-2-butyl-3-(3-oxo-3-phenylpropyl)-1-phenylhept-2-enyl]propanedinitrile IUPAC Name: 2-[(Z)-2-butyl-3-(3-oxo-3-phenylpropyl)-1-phenylhept-2-enyl]propanedinitrile Traditional Name: 2-[(Z)-2-butyl-3-(3-keto-3-phenyl-propyl)-1-phenyl-hept-2-enyl]malononitrile Formula: C29H34N2O MolecularWeight: 426.59306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC/C(=C(\CCCC)/C(C1=CC=CC=C1)C(C#N)C#N)/CCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C29H34N2O/c1-3-5-13-23(19-20-28(32)24-14-9-7-10-15-24)27(18-6-4-2)29(26(21-30)22-31)25-16-11-8-12-17-25/h7-12,14-17,26,29H,3-6,13,18-20H2,1-2H3/b27-23-