bis[(3R,6S)-3-methyl-6-propan-2-yl-cyclohexen-1-yl] benzene-1,2-dicarboxylate

Systemtic Name: bis[(3R,6S)-3-methyl-6-propan-2-yl-cyclohexen-1-yl] benzene-1,2-dicarboxylate Openeye Name: bis[(3R,6S)-6-isopropyl-3-methyl-cyclohexen-1-yl] benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis[(3R,6S)-3-methyl-6-propan-2-yl-1-cyclohexenyl] ester IUPAC Name: bis[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl] benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis[(3R,6S)-6-isopropyl-3-methyl-cyclohexen-1-yl] ester Formula: C28H38O4 MolecularWeight: 438.59892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=C1)OC(=O)C2=CC=CC=C2C(=O)OC3=CC(CCC3C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H](C(=C1)OC(=O)C2=CC=CC=C2C(=O)OC3=C[C@@H](CC[C@H]3C(C)C)C)C(C)C

InChI

InChI=1S/C28H38O4/c1-17(2)21-13-11-19(5)15-25(21)31-27(29)23-9-7-8-10-24(23)28(30)32-26-16-20(6)12-14-22(26)18(3)4/h7-10,15-22H,11-14H2,1-6H3/t19-,20-,21+,22+/m1/s1