[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2,5-dimethoxybenzoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2,5-dimethoxybenzoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2,5-dimethoxybenzoate CAS Name: 2,5-dimethoxybenzoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2,5-dimethoxybenzoate Traditional Name: 2,5-dimethoxybenzoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C19H28O4 MolecularWeight: 320.42322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=C(C=CC(=C2)OC)OC)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H28O4/c1-12(2)15-8-6-13(3)10-18(15)23-19(20)16-11-14(21-4)7-9-17(16)22-5/h7,9,11-13,15,18H,6,8,10H2,1-5H3/t13-,15+,18-/m1/s1