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

Systemtic Name: 2-ethyl-4-(phenylmethoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 4-(benzyloxycarbonylamino)-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: 2-ethyl-4-(phenylmethoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 2-ethyl-4-(phenylmethoxycarbonylamino)-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 4-(benzyloxycarbonylamino)-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C21H21F3N2O4 MolecularWeight: 422.39765

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C2=C(N1C(=O)O)C=CC(=C2)C(F)(F)F)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1CC(C2=C(N1C(=O)O)C=CC(=C2)C(F)(F)F)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H21F3N2O4/c1-2-15-11-17(25-19(27)30-12-13-6-4-3-5-7-13)16-10-14(21(22,23)24)8-9-18(16)26(15)20(28)29/h3-10,15,17H,2,11-12H2,1H3,(H,25,27)(H,28,29)