N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)N(C)C

InChI

InChI=1S/C21H26N4O5S/c1-15-8-9-17(14-20(15)31(29,30)23(2)3)22-21(26)16-10-12-24(13-11-16)18-6-4-5-7-19(18)25(27)28/h4-9,14,16H,10-13H2,1-3H3,(H,22,26)