dimethyl (1R,2S)-2-(4-fluorophenyl)-4,6-dimethyl-cyclohexa-3,5-diene-1,3-dicarboxylate

Systemtic Name: dimethyl (1R,2S)-2-(4-fluorophenyl)-4,6-dimethyl-cyclohexa-3,5-diene-1,3-dicarboxylate Openeye Name: dimethyl (1R,2S)-2-(4-fluorophenyl)-4,6-dimethyl-cyclohexa-3,5-diene-1,3-dicarboxylate CAS Name: (1R,2S)-2-(4-fluorophenyl)-4,6-dimethylcyclohexa-3,5-diene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,2S)-2-(4-fluorophenyl)-4,6-dimethylcyclohexa-3,5-diene-1,3-dicarboxylate Traditional Name: (1R,2S)-2-(4-fluorophenyl)-4,6-dimethyl-cyclohexa-3,5-diene-1,3-dicarboxylic acid dimethyl ester Formula: C18H19FO4 MolecularWeight: 318.339463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(C1C(=O)OC)C2=CC=C(C=C2)F)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C([C@@H]([C@H]1C(=O)OC)C2=CC=C(C=C2)F)C(=O)OC)C

InChI

InChI=1S/C18H19FO4/c1-10-9-11(2)15(18(21)23-4)16(14(10)17(20)22-3)12-5-7-13(19)8-6-12/h5-9,14,16H,1-4H3/t14-,16+/m0/s1