ethyl 3-methyl-4,6-bis(oxidanylidene)-2-phenyl-cyclohexane-1-carboxylate

Systemtic Name: ethyl 3-methyl-4,6-bis(oxidanylidene)-2-phenyl-cyclohexane-1-carboxylate Openeye Name: ethyl 3-methyl-4,6-dioxo-2-phenyl-cyclohexanecarboxylate CAS Name: 3-methyl-4,6-dioxo-2-phenyl-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4,6-dioxo-2-phenylcyclohexane-1-carboxylate Traditional Name: 4,6-diketo-3-methyl-2-phenyl-cyclohexanecarboxylic acid ethyl ester Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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