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

Systemtic Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxidanylidene-propyl]-N-phenyl-pyridin-1-ium-3-carboxamide Openeye Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxo-propyl]-N-phenyl-pyridin-1-ium-3-carboxamide CAS Name: 1-[3-[3-[(E)-hydroxyiminomethyl]-1-pyridin-1-iumyl]-2-oxopropyl]-N-phenyl-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]-2-oxopropyl]-N-phenylpyridin-1-ium-3-carboxamide Traditional Name: 1-[3-[3-[(E)-hydroximinomethyl]pyridin-1-ium-1-yl]-2-keto-propyl]-N-phenyl-pyridin-1-ium-3-carboxamide Formula: C21H20N4O3+2 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)CC(=O)C[N+]3=CC=CC(=C3)C=NO

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)CC(=O)C[N+]3=CC=CC(=C3)/C=N/O

InChI

InChI=1S/C21H18N4O3/c26-20(15-24-10-4-6-17(13-24)12-22-28)16-25-11-5-7-18(14-25)21(27)23-19-8-2-1-3-9-19/h1-14H,15-16H2/p+2/b22-12+