(3,5-dimethoxyphenyl)methyl-[(1S,2S,3S)-2,3-dimethylcyclohexyl]azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-[(1S,2S,3S)-2,3-dimethylcyclohexyl]azanium Openeye Name: (3,5-dimethoxyphenyl)methyl-[(1S,2S,3S)-2,3-dimethylcyclohexyl]ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-[(1S,2S,3S)-2,3-dimethylcyclohexyl]ammonium IUPAC Name: (3,5-dimethoxyphenyl)methyl-[(1S,2S,3S)-2,3-dimethylcyclohexyl]azanium Traditional Name: (3,5-dimethoxybenzyl)-[(1S,2S,3S)-2,3-dimethylcyclohexyl]ammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@H]1C)[NH2+]CC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C17H27NO2/c1-12-6-5-7-17(13(12)2)18-11-14-8-15(19-3)10-16(9-14)20-4/h8-10,12-13,17-18H,5-7,11H2,1-4H3/p+1/t12-,13-,17-/m0/s1