ethyl 2-[4-[[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyl-1,2,3,4-tetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]cyclohexyl]ethanoate

Systemtic Name: ethyl 2-[4-[[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyl-1,2,3,4-tetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]carbonyl]cyclohexyl]ethanoate Openeye Name: ethyl 2-[4-[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyltetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]cyclohexyl]acetate CAS Name: 2-[4-[[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyl-5-tetrazolyl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]-oxomethyl]cyclohexyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyltetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]cyclohexyl]acetate Traditional Name: 2-[4-[4-[[3,5-bis(trifluoromethyl)phenyl]-(2-methyltetrazol-5-yl)methyl]-2-ethyl-6-(trifluoromethyl)-3,4-dihydro-2H-quinoline-1-carbonyl]cyclohexyl]acetic acid ethyl ester Formula: C34H36F9N5O3 MolecularWeight: 733.666969

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C2=C(N1C(=O)C3CCC(CC3)CC(=O)OCC)C=CC(=C2)C(F)(F)F)C(C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=NN(N=N5)C

Isomeric SMILES

CCC1CC(C2=C(N1C(=O)C3CCC(CC3)CC(=O)OCC)C=CC(=C2)C(F)(F)F)C(C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=NN(N=N5)C

InChI

InChI=1S/C34H36F9N5O3/c1-4-24-17-26(29(30-44-46-47(3)45-30)20-13-22(33(38,39)40)15-23(14-20)34(41,42)43)25-16-21(32(35,36)37)10-11-27(25)48(24)31(50)19-8-6-18(7-9-19)12-28(49)51-5-2/h10-11,13-16,18-19,24,26,29H,4-9,12,17H2,1-3H3