[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3,4-dimethoxybenzoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3,4-dimethoxybenzoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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