3-(hydroxymethyl)-3aH-benzotriazol-4-one

Systemtic Name: 3-(hydroxymethyl)-3aH-benzotriazol-4-one Openeye Name: 3-(hydroxymethyl)-3aH-benzotriazol-4-one CAS Name: 3-(hydroxymethyl)-3aH-benzotriazol-4-one IUPAC Name: 3-(hydroxymethyl)-3aH-benzotriazol-4-one Traditional Name: 3-methylol-3aH-benzotriazol-4-one Formula: C7H7N3O2 MolecularWeight: 165.14938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C2C(=C1)N=NN2CO

Isomeric SMILES

C1=CC(=O)C2C(=C1)N=NN2CO

InChI

InChI=1S/C7H7N3O2/c11-4-10-7-5(8-9-10)2-1-3-6(7)12/h1-3,7,11H,4H2