methyl 2-(4-fluoranyl-3-methyl-phenyl)-6,6-dimethyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl 2-(4-fluoranyl-3-methyl-phenyl)-6,6-dimethyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl 2-(4-fluoro-3-methyl-phenyl)-6,6-dimethyl-cyclohex-2-ene-1-carboxylate CAS Name: 2-(4-fluoro-3-methylphenyl)-6,6-dimethyl-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-fluoro-3-methylphenyl)-6,6-dimethylcyclohex-2-ene-1-carboxylate Traditional Name: 2-(4-fluoro-3-methyl-phenyl)-6,6-dimethyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C17H21FO2 MolecularWeight: 276.345843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CCCC(C2C(=O)OC)(C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CCCC(C2C(=O)OC)(C)C)F

InChI

InChI=1S/C17H21FO2/c1-11-10-12(7-8-14(11)18)13-6-5-9-17(2,3)15(13)16(19)20-4/h6-8,10,15H,5,9H2,1-4H3