(1R,2S,5R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propan-2-yl-cyclohexane-1-carboxamide

Systemtic Name: (1R,2S,5R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propan-2-yl-cyclohexane-1-carboxamide Openeye Name: (1R,2S,5R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-isopropyl-5-methyl-cyclohexanecarboxamide CAS Name: (1R,2S,5R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propan-2-yl-1-cyclohexanecarboxamide IUPAC Name: (1R,2S,5R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide Traditional Name: (1R,2S,5R)-N-homoveratryl-2-isopropyl-5-methyl-cyclohexanecarboxamide Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)C(=O)NCCC2=CC(=C(C=C2)OC)OC)C(C)C

InChI

InChI=1S/C21H33NO3/c1-14(2)17-8-6-15(3)12-18(17)21(23)22-11-10-16-7-9-19(24-4)20(13-16)25-5/h7,9,13-15,17-18H,6,8,10-12H2,1-5H3,(H,22,23)/t15-,17+,18-/m1/s1