(6-methoxypyridin-3-yl)methyl-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]azanium

Systemtic Name: (6-methoxypyridin-3-yl)methyl-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]azanium Openeye Name: [(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]-[(6-methoxy-3-pyridyl)methyl]ammonium CAS Name: (6-methoxy-3-pyridinyl)methyl-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]ammonium IUPAC Name: (6-methoxypyridin-3-yl)methyl-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]azanium Traditional Name: [(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]-[(6-methoxy-3-pyridyl)methyl]ammonium Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CC2=CN=C(C=C2)OC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](C1)[NH2+]CC2=CN=C(C=C2)OC)C(C)C

InChI

InChI=1S/C17H28N2O/c1-12(2)15-7-5-13(3)9-16(15)18-10-14-6-8-17(20-4)19-11-14/h6,8,11-13,15-16,18H,5,7,9-10H2,1-4H3/p+1/t13-,15-,16+/m1/s1