methyl 2-(4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)-2-(2-methylphenyl)-2-oxidanyl-ethanoate

Systemtic Name: methyl 2-(4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)-2-(2-methylphenyl)-2-oxidanyl-ethanoate Openeye Name: methyl 2-(4,4-dimethyl-6-oxo-cyclohexen-1-yl)-2-hydroxy-2-(o-tolyl)acetate CAS Name: 2-(4,4-dimethyl-6-oxo-1-cyclohexenyl)-2-hydroxy-2-(2-methylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(4,4-dimethyl-6-oxocyclohexen-1-yl)-2-hydroxy-2-(2-methylphenyl)acetate Traditional Name: 2-hydroxy-2-(6-keto-4,4-dimethyl-cyclohexen-1-yl)-2-(o-tolyl)acetic acid methyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CCC(CC2=O)(C)C)(C(=O)OC)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CCC(CC2=O)(C)C)(C(=O)OC)O

InChI

InChI=1S/C18H22O4/c1-12-7-5-6-8-13(12)18(21,16(20)22-4)14-9-10-17(2,3)11-15(14)19/h5-9,21H,10-11H2,1-4H3