N-(6-methoxypyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(6-methoxy-3-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(6-methoxy-3-pyridinyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(6-methoxypyridin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(6-methoxy-3-pyridyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C19H19F3N4O4 MolecularWeight: 424.37377

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19F3N4O4/c1-30-17-5-3-14(11-23-17)24-18(27)12-6-8-25(9-7-12)15-4-2-13(19(20,21)22)10-16(15)26(28)29/h2-5,10-12H,6-9H2,1H3,(H,24,27)