N-(1-methylsulfonylpiperidin-4-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(1-mesyl-4-piperidyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C19H25F3N4O5S MolecularWeight: 478.48581

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H25F3N4O5S/c1-32(30,31)25-10-6-15(7-11-25)23-18(27)13-4-8-24(9-5-13)16-3-2-14(19(20,21)22)12-17(16)26(28)29/h2-3,12-13,15H,4-11H2,1H3,(H,23,27)