N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-3-nitro-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-3-nitro-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-[(Z)-(3,4-dimethoxyphenyl)methyleneamino]-3-nitro-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-3-nitro-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-[(Z)-(3,4-dimethoxyphenyl)methylideneamino]-3-nitro-1H-1,2,4-triazole-5-carboxamide Traditional Name: 3-nitro-N-[(Z)-veratrylideneamino]-1H-1,2,4-triazole-5-carboxamide Formula: C12H12N6O5 MolecularWeight: 320.26088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=NC(=NN2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\NC(=O)C2=NC(=NN2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H12N6O5/c1-22-8-4-3-7(5-9(8)23-2)6-13-16-11(19)10-14-12(17-15-10)18(20)21/h3-6H,1-2H3,(H,16,19)(H,14,15,17)/b13-6-