2-(3,4-dimethoxyphenyl)ethyl-[(1R,2R)-2-methylcyclohexyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R,2R)-2-methylcyclohexyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R,2R)-2-methylcyclohexyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R,2R)-2-methylcyclohexyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(1R,2R)-2-methylcyclohexyl]azanium Traditional Name: homoveratryl-[(1R,2R)-2-methylcyclohexyl]ammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[C@@H]1CCCC[C@H]1[NH2+]CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H27NO2/c1-13-6-4-5-7-15(13)18-11-10-14-8-9-16(19-2)17(12-14)20-3/h8-9,12-13,15,18H,4-7,10-11H2,1-3H3/p+1/t13-,15-/m1/s1