3-[(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxylate

Systemtic Name: 3-[(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxylate Openeye Name: 3-[(3-nitrophenyl)methyleneamino]-1H-1,2,4-triazole-5-carboxylate CAS Name: 3-[(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxylate IUPAC Name: 3-[(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxylate Traditional Name: 3-[(3-nitrobenzylidene)amino]-1H-1,2,4-triazole-5-carboxylate Formula: C10H6N5O4- MolecularWeight: 260.18574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=NNC(=N2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C=NC2=NNC(=N2)C(=O)[O-]

InChI

InChI=1S/C10H7N5O4/c16-9(17)8-12-10(14-13-8)11-5-6-2-1-3-7(4-6)15(18)19/h1-5H,(H,16,17)(H,12,13,14)/p-1