ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 4-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonylamino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonylamino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 4-[[3,5-bis(trifluoromethyl)benzyl]-carbomethoxy-amino]-6-ethyl-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester Formula: C26H28F6N2O4 MolecularWeight: 546.501939

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(CC2N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC)C)C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(CC2N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC)C)C(=O)OCC

InChI

InChI=1S/C26H28F6N2O4/c1-5-16-7-8-21-20(12-16)22(9-15(3)34(21)24(36)38-6-2)33(23(35)37-4)14-17-10-18(25(27,28)29)13-19(11-17)26(30,31)32/h7-8,10-13,15,22H,5-6,9,14H2,1-4H3