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

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-[[3-(methylsulfamoyl)phenyl]methyl]-5-nitro-benzamide Openeye Name: 2-(4-methyl-1-piperidyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]-5-nitro-benzamide CAS Name: 2-(4-methyl-1-piperidinyl)-N-[[3-(methylsulfamoyl)phenyl]methyl]-5-nitrobenzamide IUPAC Name: 2-(4-methylpiperidin-1-yl)-N-[[3-(methylsulfamoyl)phenyl]methyl]-5-nitrobenzamide Traditional Name: 2-(4-methylpiperidino)-N-[3-(methylsulfamoyl)benzyl]-5-nitro-benzamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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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(=CC=C3)S(=O)(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O5S/c1-15-8-10-24(11-9-15)20-7-6-17(25(27)28)13-19(20)21(26)23-14-16-4-3-5-18(12-16)31(29,30)22-2/h3-7,12-13,15,22H,8-11,14H2,1-2H3,(H,23,26)