methyl (1R,3R)-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-2-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,3R)-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-2-oxidanyl-cyclohexane-1-carboxylate Openeye Name: methyl (1R,3R)-2-hydroxy-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-cyclohexanecarboxylate CAS Name: (1R,3R)-2-hydroxy-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3R)-2-hydroxy-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethylcyclohexane-1-carboxylate Traditional Name: (1R,3R)-2-hydroxy-2-[2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1(CCC2=CC=C(C=C2)OC)O)(C)C(=O)OC

Isomeric SMILES

C[C@@H]1CCC[C@@](C1(CCC2=CC=C(C=C2)OC)O)(C)C(=O)OC

InChI

InChI=1S/C19H28O4/c1-14-6-5-12-18(2,17(20)23-4)19(14,21)13-11-15-7-9-16(22-3)10-8-15/h7-10,14,21H,5-6,11-13H2,1-4H3/t14-,18+,19?/m1/s1