N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(bromomethyl)-4-phenyl-quinoline-3-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(bromomethyl)-4-phenyl-quinoline-3-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(bromomethyl)-4-phenyl-quinoline-3-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(bromomethyl)-4-phenyl-3-quinolinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(bromomethyl)-4-phenylquinoline-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-2-(bromomethyl)-4-phenyl-quinoline-3-carboxamide Formula: C26H17BrF6N2O MolecularWeight: 567.320399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC3=CC=CC=C32)CBr)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC3=CC=CC=C32)CBr)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H17BrF6N2O/c27-13-21-23(22(16-6-2-1-3-7-16)19-8-4-5-9-20(19)35-21)24(36)34-14-15-10-17(25(28,29)30)12-18(11-15)26(31,32)33/h1-12H,13-14H2,(H,34,36)