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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-butylbenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H19N3O3/c1-2-3-6-14-9-11-15(12-10-14)19(24)25-13-22-18(23)16-7-4-5-8-17(16)20-21-22/h4-5,7-12H,2-3,6,13H2,1H3