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

Systemtic Name: N-[4-methyl-2-[[3-(trifluoromethyl)phenyl]amino]quinolin-6-yl]-3-nitro-benzamide Openeye Name: N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolyl]-3-nitro-benzamide CAS Name: N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolinyl]-3-nitrobenzamide IUPAC Name: N-[4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl]-3-nitrobenzamide Traditional Name: N-[4-methyl-2-[3-(trifluoromethyl)anilino]-6-quinolyl]-3-nitro-benzamide Formula: C24H17F3N4O3 MolecularWeight: 466.41199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17F3N4O3/c1-14-10-22(28-17-6-3-5-16(12-17)24(25,26)27)30-21-9-8-18(13-20(14)21)29-23(32)15-4-2-7-19(11-15)31(33)34/h2-13H,1H3,(H,28,30)(H,29,32)