[(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] 3-oxidanylidenecyclohexene-1-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] 3-oxidanylidenecyclohexene-1-carboxylate Openeye Name: [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] 3-oxocyclohexene-1-carboxylate CAS Name: 3-oxo-1-cyclohexenecarboxylic acid [(1R,2S,5R)-5-methyl-2-[2-(2-naphthalenyl)propan-2-yl]cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] 3-oxocyclohexene-1-carboxylate Traditional Name: 3-ketocyclohexene-1-carboxylic acid [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] ester Formula: C27H32O3 MolecularWeight: 404.54118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC(=O)CCC2)C(C)(C)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2=CC(=O)CCC2)C(C)(C)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H32O3/c1-18-11-14-24(25(15-18)30-26(29)21-9-6-10-23(28)17-21)27(2,3)22-13-12-19-7-4-5-8-20(19)16-22/h4-5,7-8,12-13,16-18,24-25H,6,9-11,14-15H2,1-3H3/t18-,24-,25-/m1/s1