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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=CC=CC=C2N1C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(CC(=O)C2=CC=CC=C2N1C(=O)OC(C)(C)C)C

InChI

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