(2R,4S)-4-azanyl-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid

Systemtic Name: (2R,4S)-4-azanyl-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: (2R,4S)-4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: (2R,4S)-4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: (2R,4S)-4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: (2R,4S)-4-amino-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C13H15F3N2O2 MolecularWeight: 288.26561

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C2=C(N1C(=O)O)C=CC(=C2)C(F)(F)F)N

Isomeric SMILES

CC[C@@H]1C[C@@H](C2=C(N1C(=O)O)C=CC(=C2)C(F)(F)F)N

InChI

InChI=1S/C13H15F3N2O2/c1-2-8-6-10(17)9-5-7(13(14,15)16)3-4-11(9)18(8)12(19)20/h3-5,8,10H,2,6,17H2,1H3,(H,19,20)/t8-,10+/m1/s1