N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[3-(ethylcarbamoyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H23F3N4O4 MolecularWeight: 464.43763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23F3N4O4/c1-2-26-20(30)15-4-3-5-17(12-15)27-21(31)14-8-10-28(11-9-14)18-7-6-16(22(23,24)25)13-19(18)29(32)33/h3-7,12-14H,2,8-11H2,1H3,(H,26,30)(H,27,31)