methyl 5-oxidanylidene-2-phenyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 5-oxidanylidene-2-phenyl-cyclohexane-1-carboxylate Openeye Name: methyl 5-oxo-2-phenyl-cyclohexanecarboxylate CAS Name: 5-oxo-2-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-oxo-2-phenylcyclohexane-1-carboxylate Traditional Name: 5-keto-2-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=O)CCC1C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CC(=O)CCC1C2=CC=CC=C2

InChI

InChI=1S/C14H16O3/c1-17-14(16)13-9-11(15)7-8-12(13)10-5-3-2-4-6-10/h2-6,12-13H,7-9H2,1H3