dimethyl (1R,2S,3S)-3-cyclopropyl-3-(1-phenylethenyl)cyclohex-4-ene-1,2-dicarboxylate

Systemtic Name: dimethyl (1R,2S,3S)-3-cyclopropyl-3-(1-phenylethenyl)cyclohex-4-ene-1,2-dicarboxylate Openeye Name: dimethyl (1R,2S,3S)-3-cyclopropyl-3-(1-phenylvinyl)cyclohex-4-ene-1,2-dicarboxylate CAS Name: (1R,2S,3S)-3-cyclopropyl-3-(1-phenylethenyl)cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,2S,3S)-3-cyclopropyl-3-(1-phenylethenyl)cyclohex-4-ene-1,2-dicarboxylate Traditional Name: (1R,2S,3S)-3-cyclopropyl-3-(1-phenylvinyl)cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CC(C1C(=O)OC)(C2CC2)C(=C)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1CC=C[C@]([C@H]1C(=O)OC)(C2CC2)C(=C)C3=CC=CC=C3

InChI

InChI=1S/C21H24O4/c1-14(15-8-5-4-6-9-15)21(16-11-12-16)13-7-10-17(19(22)24-2)18(21)20(23)25-3/h4-9,13,16-18H,1,10-12H2,2-3H3/t17-,18-,21-/m1/s1