tert-butyl 4-oxidanyl-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylate

Systemtic Name: tert-butyl 4-oxidanyl-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylate Openeye Name: tert-butyl 4-hydroxy-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylate CAS Name: 4-hydroxy-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylate Traditional Name: 4-hydroxy-4-propyl-2-(trifluoromethyl)-2,3-dihydroquinoline-1-carboxylic acid tert-butyl ester Formula: C18H24F3NO3 MolecularWeight: 359.38327

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)C(F)(F)F)O

Isomeric SMILES

CCCC1(CC(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)C(F)(F)F)O

InChI

InChI=1S/C18H24F3NO3/c1-5-10-17(24)11-14(18(19,20)21)22(15(23)25-16(2,3)4)13-9-7-6-8-12(13)17/h6-9,14,24H,5,10-11H2,1-4H3