methyl 1,3-dimethyl-2-oxidanylidene-3-phenyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 1,3-dimethyl-2-oxidanylidene-3-phenyl-cyclohexane-1-carboxylate Openeye Name: methyl 1,3-dimethyl-2-oxo-3-phenyl-cyclohexanecarboxylate CAS Name: 1,3-dimethyl-2-oxo-3-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1,3-dimethyl-2-oxo-3-phenylcyclohexane-1-carboxylate Traditional Name: 2-keto-1,3-dimethyl-3-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1=O)(C)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1(CCCC(C1=O)(C)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H20O3/c1-15(12-8-5-4-6-9-12)10-7-11-16(2,13(15)17)14(18)19-3/h4-6,8-9H,7,10-11H2,1-3H3