tert-butyl 3,3-dimethyl-4-oxidanylidene-2H-quinoline-1-carboxylate

Systemtic Name: tert-butyl 3,3-dimethyl-4-oxidanylidene-2H-quinoline-1-carboxylate Openeye Name: tert-butyl 3,3-dimethyl-4-oxo-2H-quinoline-1-carboxylate CAS Name: 3,3-dimethyl-4-oxo-2H-quinoline-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,3-dimethyl-4-oxo-2H-quinoline-1-carboxylate Traditional Name: 4-keto-3,3-dimethyl-2H-quinoline-1-carboxylic acid tert-butyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=CC=CC=C2C1=O)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(CN(C2=CC=CC=C2C1=O)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C16H21NO3/c1-15(2,3)20-14(19)17-10-16(4,5)13(18)11-8-6-7-9-12(11)17/h6-9H,10H2,1-5H3