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

Systemtic Name: ethyl 3-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]benzoate Openeye Name: ethyl 3-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate CAS Name: 3-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]benzoate Traditional Name: 3-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]benzoic acid ethyl ester Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H15N3O3/c1-2-23-17(22)13-7-5-6-12(10-13)11-20-16(21)14-8-3-4-9-15(14)18-19-20/h3-10H,2,11H2,1H3