N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)N(C)C

InChI

InChI=1S/C22H28N4O5S/c1-15-13-18(32(30,31)24(3)4)14-19(16(15)2)23-22(27)17-9-11-25(12-10-17)20-7-5-6-8-21(20)26(28)29/h5-8,13-14,17H,9-12H2,1-4H3,(H,23,27)