N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-4-methyl-3-nitro-benzamide Formula: C22H28N4O5S MolecularWeight: 460.54652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O5S/c1-4-25(5-2)32(30,31)18-10-11-20(24-12-6-7-13-24)19(15-18)23-22(27)17-9-8-16(3)21(14-17)26(28)29/h8-11,14-15H,4-7,12-13H2,1-3H3,(H,23,27)