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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H17ClF3N3O5 MolecularWeight: 471.81429

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=C(C=C(C(=C4)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C4=C(C=C(C(=C4)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClF3N3O5/c21-14-9-15(16(27(29)30)8-13(14)20(22,23)24)26-5-3-11(4-6-26)19(28)25-12-1-2-17-18(7-12)32-10-31-17/h1-2,7-9,11H,3-6,10H2,(H,25,28)