(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-pyrazol-1-ylbenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C18H13N5O3 MolecularWeight: 347.32752

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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=CC=N4

Isomeric SMILES

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

InChI

InChI=1S/C18H13N5O3/c24-17-15-4-1-2-5-16(15)20-21-23(17)12-26-18(25)13-6-8-14(9-7-13)22-11-3-10-19-22/h1-11H,12H2