1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(4-sulfamoylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-(4-sulfamoylbenzyl)isonipecotamide Formula: C20H21F3N4O5S MolecularWeight: 486.46475

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21F3N4O5S/c21-20(22,23)15-3-6-17(18(11-15)27(29)30)26-9-7-14(8-10-26)19(28)25-12-13-1-4-16(5-2-13)33(24,31)32/h1-6,11,14H,7-10,12H2,(H,25,28)(H2,24,31,32)