1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxidanylidene-propyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxidanylidene-propyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxo-propyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[3-[3-[(E)-hydroxyiminomethyl]-1-pyridin-1-iumyl]-2-oxopropyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxopropyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[3-[3-[(E)-hydroximinomethyl]pyridin-1-ium-1-yl]-2-keto-propyl]pyridin-1-ium-3-carboxamide Formula: C15H16N4O3+2 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)C[N+]2=CC=CC(=C2)C(=O)N)C=NO

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O3/c16-15(21)13-4-2-6-19(9-13)11-14(20)10-18-5-1-3-12(8-18)7-17-22/h1-9H,10-11H2,(H-2,16,21,22)/p+2/b17-7+