2-(3,4-dimethoxyphenyl)ethyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(6-methyl-2-pyridyl)methyl]-(4-pyridylmethyl)ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(6-methyl-2-pyridinyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: homoveratryl-[(6-methyl-2-pyridyl)methyl]-(4-pyridylmethyl)ammonium Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+](CCC2=CC(=C(C=C2)OC)OC)CC3=CC=NC=C3

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+](CCC2=CC(=C(C=C2)OC)OC)CC3=CC=NC=C3

InChI

InChI=1S/C23H27N3O2/c1-18-5-4-6-21(25-18)17-26(16-20-9-12-24-13-10-20)14-11-19-7-8-22(27-2)23(15-19)28-3/h4-10,12-13,15H,11,14,16-17H2,1-3H3/p+1