(1Z)-1-(azanylmethylidene)benzotriazol-1-ium-4,5-dicarboxylic acid

Systemtic Name: (1Z)-1-(azanylmethylidene)benzotriazol-1-ium-4,5-dicarboxylic acid Openeye Name: (1Z)-1-(aminomethylene)benzotriazol-1-ium-4,5-dicarboxylic acid CAS Name: (1Z)-1-(aminomethylidene)benzotriazol-1-ium-4,5-dicarboxylic acid IUPAC Name: (1Z)-1-(aminomethylidene)benzotriazol-1-ium-4,5-dicarboxylic acid Traditional Name: (1Z)-1-(aminomethylene)benzotriazol-1-ium-4,5-dicarboxylic acid Formula: C9H7N4O4+ MolecularWeight: 235.17628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1C(=O)O)C(=O)O)N=N[N+]2=CN

Isomeric SMILES

C1=CC\2=C(C(=C1C(=O)O)C(=O)O)N=N/[N+]2=C\N

InChI

InChI=1S/C9H6N4O4/c10-3-13-5-2-1-4(8(14)15)6(9(16)17)7(5)11-12-13/h1-3,10H,(H2,14,15,16,17)/p+1