1-oxidanidyl-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-oxidanidyl-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyridin-1-ium-3-carboxamide Openeye Name: 1-oxido-N-[(E)-(3,4,5-trimethoxyphenyl)methyleneamino]pyridin-1-ium-3-carboxamide CAS Name: 1-oxido-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyridin-1-ium-3-carboxamide Traditional Name: 1-oxido-N-[(E)-(3,4,5-trimethoxybenzylidene)amino]pyridin-1-ium-3-carboxamide Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=NNC(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5/c1-22-13-7-11(8-14(23-2)15(13)24-3)9-17-18-16(20)12-5-4-6-19(21)10-12/h4-10H,1-3H3,(H,18,20)/b17-9+