N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-piperidin-1-ium-4-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-piperidin-1-ium-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-piperidin-1-ium-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-4-piperidin-1-iumamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylpiperidin-1-ium-4-amine Traditional Name: homoveratryl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C16H27N2O2+ MolecularWeight: 279.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[NH+]1CCC(CC1)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H26N2O2/c1-18-10-7-14(8-11-18)17-9-6-13-4-5-15(19-2)16(12-13)20-3/h4-5,12,14,17H,6-11H2,1-3H3/p+1