methyl 5-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: methyl 5-(4-oxo-1,2,3-benzotriazin-3-yl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(4-oxo-1,2,3-benzotriazin-3-yl)-1-phenyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-oxo-1,2,3-benzotriazin-3-yl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(4-keto-1,2,3-benzotriazin-3-yl)-1-phenyl-pyrazole-4-carboxylic acid methyl ester Formula: C18H13N5O3 MolecularWeight: 347.32752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H13N5O3/c1-26-18(25)14-11-19-22(12-7-3-2-4-8-12)16(14)23-17(24)13-9-5-6-10-15(13)20-21-23/h2-11H,1H3