ethyl 2-(4-methylphenyl)-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: ethyl 2,4-dioxo-6-(p-tolyl)cyclohexanecarboxylate CAS Name: 2-(4-methylphenyl)-4,6-dioxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylphenyl)-4,6-dioxocyclohexane-1-carboxylate Traditional Name: 2,4-diketo-6-(p-tolyl)cyclohexanecarboxylic acid ethyl ester Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=O)CC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1C(CC(=O)CC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H18O4/c1-3-20-16(19)15-13(8-12(17)9-14(15)18)11-6-4-10(2)5-7-11/h4-7,13,15H,3,8-9H2,1-2H3