4-methoxy-N-[4-methyl-2-[[3-(trifluoromethyl)phenyl]amino]quinolin-6-yl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[4-methyl-2-[[3-(trifluoromethyl)phenyl]amino]quinolin-6-yl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolinyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolyl]-3-nitro-benzamide Formula: C25H19F3N4O4 MolecularWeight: 496.43797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H19F3N4O4/c1-14-10-23(29-17-5-3-4-16(12-17)25(26,27)28)31-20-8-7-18(13-19(14)20)30-24(33)15-6-9-22(36-2)21(11-15)32(34)35/h3-13H,1-2H3,(H,29,31)(H,30,33)