N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyridin-1-ium-4-yl]ethanamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyridin-1-ium-4-yl]ethanamide Openeye Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyridin-1-ium-4-yl]acetamide CAS Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyridin-1-iumyl]acetamide IUPAC Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyridin-1-ium-4-yl]acetamide Traditional Name: N-(1-homoveratrylpyridin-1-ium-4-yl)acetamide Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=[N+](C=C1)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)NC1=CC=[N+](C=C1)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H20N2O3/c1-13(20)18-15-7-10-19(11-8-15)9-6-14-4-5-16(21-2)17(12-14)22-3/h4-5,7-8,10-12H,6,9H2,1-3H3/p+1