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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-(2-methylpropyl)benzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-isobutylbenzoate CAS Name: 4-(2-methylpropyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(2-methylpropyl)benzoate Traditional Name: 4-isobutylbenzoic 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:

CC(C)CC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H19N3O3/c1-13(2)11-14-7-9-15(10-8-14)19(24)25-12-22-18(23)16-5-3-4-6-17(16)20-21-22/h3-10,13H,11-12H2,1-2H3