3-[(5Z)-5-[(3-cyanophenyl)-oxidanyl-methylidene]-3-(2-phenylbutan-2-yl)cyclopenta-1,3-dien-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[(5Z)-5-[(3-cyanophenyl)-oxidanyl-methylidene]-3-(2-phenylbutan-2-yl)cyclopenta-1,3-dien-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[(5Z)-5-[(3-cyanophenyl)-hydroxy-methylene]-3-(1-methyl-1-phenyl-propyl)cyclopenta-1,3-diene-1-carbonyl]benzonitrile CAS Name: 3-[[(5Z)-5-[(3-cyanophenyl)-hydroxymethylidene]-3-(2-phenylbutan-2-yl)-1-cyclopenta-1,3-dienyl]-oxomethyl]benzonitrile IUPAC Name: 3-[(5Z)-5-[(3-cyanophenyl)-hydroxymethylidene]-3-(2-phenylbutan-2-yl)cyclopenta-1,3-diene-1-carbonyl]benzonitrile Traditional Name: 3-[(5Z)-5-[(3-cyanophenyl)-hydroxy-methylene]-3-(1-methyl-1-phenyl-propyl)cyclopenta-1,3-diene-1-carbonyl]benzonitrile Formula: C31H24N2O2 MolecularWeight: 456.53446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=CC=CC=C1)C2=CC(=C(C3=CC=CC(=C3)C#N)O)C(=C2)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CCC(C)(C1=CC=CC=C1)C2=C/C(=C(\C3=CC=CC(=C3)C#N)/O)/C(=C2)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C31H24N2O2/c1-3-31(2,25-13-5-4-6-14-25)26-17-27(29(34)23-11-7-9-21(15-23)19-32)28(18-26)30(35)24-12-8-10-22(16-24)20-33/h4-18,34H,3H2,1-2H3/b29-27-