ethyl 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-oxidanylidene-hept-6-enoate

Systemtic Name: ethyl 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-oxidanylidene-hept-6-enoate Openeye Name: ethyl 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-oxo-hept-6-enoate CAS Name: 2-[(3-cyano-4-phenylphenyl)methyl]-3-oxo-6-heptenoic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyano-4-phenylphenyl)methyl]-3-oxohept-6-enoate Traditional Name: 2-(3-cyano-4-phenyl-benzyl)-3-keto-hept-6-enoic acid ethyl ester Formula: C23H23NO3 MolecularWeight: 361.43362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)CCC=C

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)CCC=C

InChI

InChI=1S/C23H23NO3/c1-3-5-11-22(25)21(23(26)27-4-2)15-17-12-13-20(19(14-17)16-24)18-9-7-6-8-10-18/h3,6-10,12-14,21H,1,4-5,11,15H2,2H3