2-(3,4-dimethoxyphenyl)ethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-(pyridin-4-ylmethyl)azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-(4-pyridylmethyl)ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-(pyridin-4-ylmethyl)azanium Traditional Name: homoveratryl(4-pyridylmethyl)ammonium Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC=NC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC=NC=C2)OC

InChI

InChI=1S/C16H20N2O2/c1-19-15-4-3-13(11-16(15)20-2)5-10-18-12-14-6-8-17-9-7-14/h3-4,6-9,11,18H,5,10,12H2,1-2H3/p+1