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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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