3-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid

Systemtic Name: 3-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 3-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonyl-amino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: 3-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonylamino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 3-[[3,5-bis(trifluoromethyl)phenyl]methyl-methoxycarbonylamino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 3-[[3,5-bis(trifluoromethyl)benzyl]-carbomethoxy-amino]-7-hexoxy-6-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C29H34F6N2O6 MolecularWeight: 620.580479

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C2CC(C(N(C2=C1)C(=O)O)C)N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C2CC(C(N(C2=C1)C(=O)O)C)N(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)OC)OC

InChI

InChI=1S/C29H34F6N2O6/c1-5-6-7-8-9-43-25-15-23-19(13-24(25)41-3)12-22(17(2)37(23)26(38)39)36(27(40)42-4)16-18-10-20(28(30,31)32)14-21(11-18)29(33,34)35/h10-11,13-15,17,22H,5-9,12,16H2,1-4H3,(H,38,39)