5-azanylbenzotriazol-4-one

Systemtic Name: 5-azanylbenzotriazol-4-one Openeye Name: 5-aminobenzotriazol-4-one CAS Name: 5-amino-4-benzotriazolone IUPAC Name: 5-aminobenzotriazol-4-one Traditional Name: 5-aminobenzotriazol-4-one Formula: C6H4N4O MolecularWeight: 148.12216

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)C2=NN=NC2=C1)N

Isomeric SMILES

C1=C(C(=O)C2=NN=NC2=C1)N

InChI

InChI=1S/C6H4N4O/c7-3-1-2-4-5(6(3)11)9-10-8-4/h1-2H,7H2