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

Systemtic Name: N-[3-(2-methoxyethanoylamino)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[3-[(2-methoxyacetyl)amino]phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[3-[(2-methoxy-1-oxoethyl)amino]phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[3-[(2-methoxyacetyl)amino]phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[3-[(2-methoxyacetyl)amino]phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H23F3N4O5 MolecularWeight: 480.43703

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)NC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COCC(=O)NC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H23F3N4O5/c1-34-13-20(30)26-16-3-2-4-17(12-16)27-21(31)14-7-9-28(10-8-14)18-6-5-15(22(23,24)25)11-19(18)29(32)33/h2-6,11-12,14H,7-10,13H2,1H3,(H,26,30)(H,27,31)