N,N-dimethyl-1-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]pyridin-1-ium-3-amine

Systemtic Name: N,N-dimethyl-1-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]pyridin-1-ium-3-amine Openeye Name: 1-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]-N,N-dimethyl-pyridin-1-ium-3-amine CAS Name: N,N-dimethyl-1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]-3-pyridin-1-iumamine IUPAC Name: N,N-dimethyl-1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]pyridin-1-ium-3-amine Traditional Name: [1-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]pyridin-1-ium-3-yl]-dimethyl-amine Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC[N+]2=CC=CC(=C2)N(C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC[N+]2=CC=CC(=C2)N(C)C)C(C)C

InChI

InChI=1S/C18H31N2O/c1-14(2)17-9-8-15(3)11-18(17)21-13-20-10-6-7-16(12-20)19(4)5/h6-7,10,12,14-15,17-18H,8-9,11,13H2,1-5H3/q+1/t15-,17+,18-/m1/s1