N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O5S/c1-13-11-16(30(21,28)29)12-17(14(13)2)22-20(25)15-7-9-23(10-8-15)18-5-3-4-6-19(18)24(26)27/h3-6,11-12,15H,7-10H2,1-2H3,(H,22,25)(H2,21,28,29)