2-(3,4-dimethoxyphenyl)ethyl-methyl-piperidin-1-ium-4-yl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-piperidin-1-ium-4-yl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-piperidin-1-ium-4-yl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-(4-piperidin-1-iumyl)ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-piperidin-1-ium-4-ylazanium Traditional Name: homoveratryl-methyl-piperidin-1-ium-4-yl-ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)C2CC[NH2+]CC2

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)C2CC[NH2+]CC2

InChI

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