4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]benzoate

Systemtic Name: 4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]benzoate Openeye Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate CAS Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate IUPAC Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate Traditional Name: 4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]benzoate Formula: C15H10N3O3- MolecularWeight: 280.2582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C15H11N3O3/c19-14-12-3-1-2-4-13(12)16-17-18(14)9-10-5-7-11(8-6-10)15(20)21/h1-8H,9H2,(H,20,21)/p-1