1-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-keto-2-(3,4,5-trimethoxyanilino)ethyl]pyridin-1-ium-3-carboxamide Formula: C17H20N3O5+ MolecularWeight: 346.3578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N

InChI

InChI=1S/C17H19N3O5/c1-23-13-7-12(8-14(24-2)16(13)25-3)19-15(21)10-20-6-4-5-11(9-20)17(18)22/h4-9H,10H2,1-3H3,(H2-,18,19,21,22)/p+1