(4-oxidanylidene-3H-phthalazin-1-yl) 3,3-dimethylbutanoate

Systemtic Name: (4-oxidanylidene-3H-phthalazin-1-yl) 3,3-dimethylbutanoate Openeye Name: (4-oxo-3H-phthalazin-1-yl) 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid (4-oxo-3H-phthalazin-1-yl) ester IUPAC Name: (4-oxo-3H-phthalazin-1-yl) 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (4-keto-3H-phthalazin-1-yl) ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)(C)CC(=O)OC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H16N2O3/c1-14(2,3)8-11(17)19-13-10-7-5-4-6-9(10)12(18)15-16-13/h4-7H,8H2,1-3H3,(H,15,18)