4-(3-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-(3-methyl-1-piperidinyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-(3-methylpiperidino)-N-[4-(methylsulfamoylmethyl)benzyl]-3-nitro-benzamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC)[N+](=O)[O-]

InChI

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