N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyrazine-2-carboxamide

Systemtic Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyrazine-2-carboxamide Openeye Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]pyrazine-2-carboxamide CAS Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-pyrazinecarboxamide IUPAC Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]pyrazine-2-carboxamide Traditional Name: N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]pyrazinamide Formula: C13H9N5O5 MolecularWeight: 315.24106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9N5O5/c19-13(9-6-14-1-2-15-9)17-16-5-8-3-11-12(23-7-22-11)4-10(8)18(20)21/h1-6H,7H2,(H,17,19)/b16-5+