dimethyl (1R,2R,3S)-3-[1-(4-ethanoylphenyl)-2-methyl-prop-1-enyl]cyclohex-4-ene-1,2-dicarboxylate

Systemtic Name: dimethyl (1R,2R,3S)-3-[1-(4-ethanoylphenyl)-2-methyl-prop-1-enyl]cyclohex-4-ene-1,2-dicarboxylate Openeye Name: dimethyl (1R,2R,3S)-3-[1-(4-acetylphenyl)-2-methyl-prop-1-enyl]cyclohex-4-ene-1,2-dicarboxylate CAS Name: (1R,2R,3S)-3-[1-(4-acetylphenyl)-2-methylprop-1-enyl]cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,2R,3S)-3-[1-(4-acetylphenyl)-2-methylprop-1-enyl]cyclohex-4-ene-1,2-dicarboxylate Traditional Name: (1R,2R,3S)-3-[1-(4-acetylphenyl)-2-methyl-prop-1-enyl]cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26O5/c1-13(2)19(16-11-9-15(10-12-16)14(3)23)17-7-6-8-18(21(24)26-4)20(17)22(25)27-5/h6-7,9-12,17-18,20H,8H2,1-5H3/t17-,18-,20-/m1/s1