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

Systemtic Name: methyl 2-(4-fluoranyl-3-methyl-phenyl)-6,6-dimethyl-4-pyrrolidin-1-yl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl 2-(4-fluoro-3-methyl-phenyl)-6,6-dimethyl-4-pyrrolidin-1-yl-cyclohex-2-ene-1-carboxylate CAS Name: 2-(4-fluoro-3-methylphenyl)-6,6-dimethyl-4-(1-pyrrolidinyl)-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-fluoro-3-methylphenyl)-6,6-dimethyl-4-pyrrolidin-1-ylcyclohex-2-ene-1-carboxylate Traditional Name: 2-(4-fluoro-3-methyl-phenyl)-6,6-dimethyl-4-pyrrolidino-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C21H28FNO2 MolecularWeight: 345.450923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(CC(C2C(=O)OC)(C)C)N3CCCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(CC(C2C(=O)OC)(C)C)N3CCCC3)F

InChI

InChI=1S/C21H28FNO2/c1-14-11-15(7-8-18(14)22)17-12-16(23-9-5-6-10-23)13-21(2,3)19(17)20(24)25-4/h7-8,11-12,16,19H,5-6,9-10,13H2,1-4H3