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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H12N6O3 MolecularWeight: 348.31558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C17H12N6O3/c24-16-14-3-1-2-4-15(14)20-21-23(16)11-26-17(25)12-5-7-13(8-6-12)22-10-18-9-19-22/h1-10H,11H2