5-(4-methylphenyl)-2-[(phenylmethyl)iminomethyl]cyclohexane-1,3-dione

Systemtic Name: 5-(4-methylphenyl)-2-[(phenylmethyl)iminomethyl]cyclohexane-1,3-dione Openeye Name: 2-(benzyliminomethyl)-5-(p-tolyl)cyclohexane-1,3-dione CAS Name: 5-(4-methylphenyl)-2-[(phenylmethyl)iminomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(benzyliminomethyl)-5-(4-methylphenyl)cyclohexane-1,3-dione Traditional Name: 2-(benzyliminomethyl)-5-(p-tolyl)cyclohexane-1,3-quinone Formula: C21H21NO2 MolecularWeight: 319.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)C(C(=O)C2)C=NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)C(C(=O)C2)C=NCC3=CC=CC=C3

InChI

InChI=1S/C21H21NO2/c1-15-7-9-17(10-8-15)18-11-20(23)19(21(24)12-18)14-22-13-16-5-3-2-4-6-16/h2-10,14,18-19H,11-13H2,1H3