ethyl 4-[(4-methoxyphenyl)methyl-(phenylmethyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)methyl-(phenylmethyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-[benzyl-[(4-methoxyphenyl)methyl]amino]-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-[(4-methoxyphenyl)methyl-(phenylmethyl)amino]-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-[(4-methoxyphenyl)methyl]amino]-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-[benzyl(p-anisyl)amino]-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C28H25F3N2O3 MolecularWeight: 494.50491

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1N(CC3=CC=CC=C3)CC4=CC=C(C=C4)OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1N(CC3=CC=CC=C3)CC4=CC=C(C=C4)OC)C(F)(F)F

InChI

InChI=1S/C28H25F3N2O3/c1-3-36-27(34)24-16-32-25-15-21(28(29,30)31)11-14-23(25)26(24)33(17-19-7-5-4-6-8-19)18-20-9-12-22(35-2)13-10-20/h4-16H,3,17-18H2,1-2H3