2-(4-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-benzamide

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-benzamide Openeye Name: 2-(4-methyl-1-piperidyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitro-benzamide CAS Name: 2-(4-methyl-1-piperidinyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitrobenzamide IUPAC Name: 2-(4-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-5-nitrobenzamide Traditional Name: 2-(4-methylpiperidino)-N-[4-(methylsulfamoylmethyl)benzyl]-5-nitro-benzamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC

InChI

InChI=1S/C22H28N4O5S/c1-16-9-11-25(12-10-16)21-8-7-19(26(28)29)13-20(21)22(27)24-14-17-3-5-18(6-4-17)15-32(30,31)23-2/h3-8,13,16,23H,9-12,14-15H2,1-2H3,(H,24,27)