methyl 3-(2,2-dimethylpropanoyl)-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: methyl 3-(2,2-dimethylpropanoyl)-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: methyl 3-(2,2-dimethylpropanoyl)-4-oxo-1H-quinoline-2-carboxylate CAS Name: 3-(2,2-dimethyl-1-oxopropyl)-4-oxo-1H-quinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(2,2-dimethylpropanoyl)-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 4-keto-3-pivaloyl-1H-quinoline-2-carboxylic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=C(NC2=CC=CC=C2C1=O)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)C1=C(NC2=CC=CC=C2C1=O)C(=O)OC

InChI

InChI=1S/C16H17NO4/c1-16(2,3)14(19)11-12(15(20)21-4)17-10-8-6-5-7-9(10)13(11)18/h5-8H,1-4H3,(H,17,18)