3-nitro-4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: 3-nitro-4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: 3-nitro-4-(tetrazol-1-yl)benzoate CAS Name: 3-nitro-4-(1-tetrazolyl)benzoate IUPAC Name: 3-nitro-4-(tetrazol-1-yl)benzoate Traditional Name: 3-nitro-4-(tetrazol-1-yl)benzoate Formula: C8H4N5O4- MolecularWeight: 234.14846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)[O-])[N+](=O)[O-])N2C=NN=N2

Isomeric SMILES

C1=CC(=C(C=C1C(=O)[O-])[N+](=O)[O-])N2C=NN=N2

InChI

InChI=1S/C8H5N5O4/c14-8(15)5-1-2-6(7(3-5)13(16)17)12-4-9-10-11-12/h1-4H,(H,14,15)/p-1