1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(tetrahydrofuran-2-ylmethyl)piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(2-oxolanylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(tetrahydrofurfuryl)isonipecotamide Formula: C18H22F3N3O4 MolecularWeight: 401.38019

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H22F3N3O4/c19-18(20,21)13-3-4-15(16(10-13)24(26)27)23-7-5-12(6-8-23)17(25)22-11-14-2-1-9-28-14/h3-4,10,12,14H,1-2,5-9,11H2,(H,22,25)