N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(3-hydroxypyridin-1-ium-1-yl)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(3-hydroxy-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(3-hydroxypyridin-1-ium-1-yl)acetamide Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-veratryl-acetamide Formula: C16H19N2O4+ MolecularWeight: 303.33306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C[N+]2=CC=CC(=C2)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C[N+]2=CC=CC(=C2)O)OC

InChI

InChI=1S/C16H18N2O4/c1-21-14-6-5-12(8-15(14)22-2)9-17-16(20)11-18-7-3-4-13(19)10-18/h3-8,10H,9,11H2,1-2H3,(H-,17,19,20)/p+1