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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3,3-dimethylbutanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)CC(=O)OCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C14H17N3O3/c1-14(2,3)8-12(18)20-9-17-13(19)10-6-4-5-7-11(10)15-16-17/h4-7H,8-9H2,1-3H3