(2-methylpyrazol-3-yl) 4-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)-2-nitro-benzoate

Systemtic Name: (2-methylpyrazol-3-yl) 4-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)-2-nitro-benzoate Openeye Name: (2-methylpyrazol-3-yl) 4-(4-methyl-5-oxo-tetrazol-1-yl)-2-nitro-benzoate CAS Name: 4-(4-methyl-5-oxo-1-tetrazolyl)-2-nitrobenzoic acid (2-methyl-3-pyrazolyl) ester IUPAC Name: (2-methylpyrazol-3-yl) 4-(4-methyl-5-oxotetrazol-1-yl)-2-nitrobenzoate Traditional Name: 4-(5-keto-4-methyl-tetrazol-1-yl)-2-nitro-benzoic acid (2-methylpyrazol-3-yl) ester Formula: C13H11N7O5 MolecularWeight: 345.27034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)N3C(=O)N(N=N3)C)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)N3C(=O)N(N=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C13H11N7O5/c1-17-11(5-6-14-17)25-12(21)9-4-3-8(7-10(9)20(23)24)19-13(22)18(2)15-16-19/h3-7H,1-2H3