[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-chloranylcyclohex-2-ene-1-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-chloranylcyclohex-2-ene-1-carboxylate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-chlorocyclohex-2-ene-1-carboxylate CAS Name: 2-chloro-1-cyclohex-2-enecarboxylic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-chlorocyclohex-2-ene-1-carboxylate Traditional Name: 2-chlorocyclohex-2-ene-1-carboxylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C17H27ClO2 MolecularWeight: 298.84808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CCCC=C2Cl)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2CCCC=C2Cl)C(C)C

InChI

InChI=1S/C17H27ClO2/c1-11(2)13-9-8-12(3)10-16(13)20-17(19)14-6-4-5-7-15(14)18/h7,11-14,16H,4-6,8-10H2,1-3H3/t12-,13+,14?,16-/m1/s1