5-nitrobenzotriazole-1-carboxylic acid

Systemtic Name: 5-nitrobenzotriazole-1-carboxylic acid Openeye Name: 5-nitrobenzotriazole-1-carboxylic acid CAS Name: 5-nitro-1-benzotriazolecarboxylic acid IUPAC Name: 5-nitrobenzotriazole-1-carboxylic acid Traditional Name: 5-nitrobenzotriazole-1-carboxylic acid Formula: C7H4N4O4 MolecularWeight: 208.13106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])N=NN2C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])N=NN2C(=O)O

InChI

InChI=1S/C7H4N4O4/c12-7(13)10-6-2-1-4(11(14)15)3-5(6)8-9-10/h1-3H,(H,12,13)