1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(2-methyl-5-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(2-methyl-5-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(2-methyl-5-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(2-methyl-5-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(2-methyl-5-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(2-methyl-5-nitro-phenyl)isonipecotamide Formula: C19H18ClF3N4O3 MolecularWeight: 442.81943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H18ClF3N4O3/c1-11-2-3-14(27(29)30)9-16(11)25-18(28)12-4-6-26(7-5-12)17-15(20)8-13(10-24-17)19(21,22)23/h2-3,8-10,12H,4-7H2,1H3,(H,25,28)