[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-oxidanylidene-1,2-dihydroindene-2-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-oxidanylidene-1,2-dihydroindene-2-carboxylate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 1-oxoindane-2-carboxylate CAS Name: 3-oxo-1,2-dihydroindene-2-carboxylic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-oxo-1,2-dihydroindene-2-carboxylate Traditional Name: 1-ketoindane-2-carboxylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H26O3 MolecularWeight: 314.41864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CC3=CC=CC=C3C2=O)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2CC3=CC=CC=C3C2=O)C(C)C

InChI

InChI=1S/C20H26O3/c1-12(2)15-9-8-13(3)10-18(15)23-20(22)17-11-14-6-4-5-7-16(14)19(17)21/h4-7,12-13,15,17-18H,8-11H2,1-3H3/t13-,15+,17?,18-/m1/s1