6-(hydroxymethyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyridine-3-carboxamide

Systemtic Name: 6-(hydroxymethyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyridine-3-carboxamide Openeye Name: 6-(hydroxymethyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]pyridine-3-carboxamide CAS Name: 6-(hydroxymethyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-3-pyridinecarboxamide IUPAC Name: 6-(hydroxymethyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyridine-3-carboxamide Traditional Name: 6-methylol-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]nicotinamide Formula: C15H12N4O6 MolecularWeight: 344.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CN=C(C=C3)CO)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)C3=CN=C(C=C3)CO)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O6/c20-7-11-2-1-9(5-16-11)15(21)18-17-6-10-3-13-14(25-8-24-13)4-12(10)19(22)23/h1-6,20H,7-8H2,(H,18,21)/b17-6+