N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-[(E)-(3,5-dimethoxyphenyl)methyleneamino]-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-pyridin-1-ium-1-ylacetamide Traditional Name: N-[(E)-(3,5-dimethoxybenzylidene)amino]-2-pyridin-1-ium-1-yl-acetamide Formula: C16H18N3O3+ MolecularWeight: 300.33242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3/c1-21-14-8-13(9-15(10-14)22-2)11-17-18-16(20)12-19-6-4-3-5-7-19/h3-11H,12H2,1-2H3/p+1/b17-11+