methyl 1-[(4-methylphenyl)methyl]-4-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(4-methylphenyl)methyl]-4-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl 4-oxo-1-(p-tolylmethyl)cyclohexanecarboxylate CAS Name: 1-[(4-methylphenyl)methyl]-4-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-methylphenyl)methyl]-4-oxocyclohexane-1-carboxylate Traditional Name: 4-keto-1-(4-methylbenzyl)cyclohexanecarboxylic acid methyl ester Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2(CCC(=O)CC2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CC2(CCC(=O)CC2)C(=O)OC

InChI

InChI=1S/C16H20O3/c1-12-3-5-13(6-4-12)11-16(15(18)19-2)9-7-14(17)8-10-16/h3-6H,7-11H2,1-2H3