methyl 2-nitro-6-(2H-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: methyl 2-nitro-6-(2H-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: methyl 2-nitro-6-(2H-tetrazol-5-yl)benzoate CAS Name: 2-nitro-6-(2H-tetrazol-5-yl)benzoic acid methyl ester IUPAC Name: methyl 2-nitro-6-(2H-tetrazol-5-yl)benzoate Traditional Name: 2-nitro-6-(2H-tetrazol-5-yl)benzoic acid methyl ester Formula: C9H7N5O4 MolecularWeight: 249.18298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1[N+](=O)[O-])C2=NNN=N2

Isomeric SMILES

COC(=O)C1=C(C=CC=C1[N+](=O)[O-])C2=NNN=N2

InChI

InChI=1S/C9H7N5O4/c1-18-9(15)7-5(8-10-12-13-11-8)3-2-4-6(7)14(16)17/h2-4H,1H3,(H,10,11,12,13)