N-[4-[bis(fluoranyl)methoxy]-2-methyl-phenyl]-6-bromanyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]-2-methyl-phenyl]-6-bromanyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[4-(difluoromethoxy)-2-methyl-phenyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[4-(difluoromethoxy)-2-methylphenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[4-(difluoromethoxy)-2-methylphenyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[4-(difluoromethoxy)-2-methyl-phenyl]-2-(4-pyridyl)cinchoninamide Formula: C23H16BrF2N3O2 MolecularWeight: 484.292846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(F)F)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)OC(F)F)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C23H16BrF2N3O2/c1-13-10-16(31-23(25)26)3-5-19(13)29-22(30)18-12-21(14-6-8-27-9-7-14)28-20-4-2-15(24)11-17(18)20/h2-12,23H,1H3,(H,29,30)