4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-1-yl]quinoline

Systemtic Name: 4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-1-yl]quinoline Openeye Name: 4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-1-yl]quinoline CAS Name: 4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)-1-pyrazolyl]quinoline IUPAC Name: 4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-1-yl]quinoline Traditional Name: 4-methyl-2-[3-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-1-yl]quinoline Formula: C20H13F3N4O2 MolecularWeight: 398.33803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=CC(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C20H13F3N4O2/c1-12-10-19(24-16-5-3-2-4-15(12)16)26-18(20(21,22)23)11-17(25-26)13-6-8-14(9-7-13)27(28)29/h2-11H,1H3