dimethyl 4-oxidanylidene-1-phenyl-cyclohexane-1,3-dicarboxylate

Systemtic Name: dimethyl 4-oxidanylidene-1-phenyl-cyclohexane-1,3-dicarboxylate Openeye Name: dimethyl 4-oxo-1-phenyl-cyclohexane-1,3-dicarboxylate CAS Name: 4-oxo-1-phenylcyclohexane-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-oxo-1-phenylcyclohexane-1,3-dicarboxylate Traditional Name: 4-keto-1-phenyl-cyclohexane-1,3-dicarboxylic acid dimethyl ester Formula: C16H18O5 MolecularWeight: 290.31112

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CCC1=O)(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1CC(CCC1=O)(C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H18O5/c1-20-14(18)12-10-16(15(19)21-2,9-8-13(12)17)11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3