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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-pyrrol-1-ylbenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H14N4O3 MolecularWeight: 346.33946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C19H14N4O3/c24-18-16-8-1-2-9-17(16)20-21-23(18)13-26-19(25)14-6-5-7-15(12-14)22-10-3-4-11-22/h1-12H,13H2