N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(dimethylamino)-5-nitro-benzamide

Systemtic Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(dimethylamino)-5-nitro-benzamide Openeye Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-2-(dimethylamino)-5-nitro-benzamide CAS Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-2-(dimethylamino)-5-nitrobenzamide IUPAC Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(dimethylamino)-5-nitrobenzamide Traditional Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-2-(dimethylamino)-5-nitro-benzamide Formula: C22H27N5O6S MolecularWeight: 489.54468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C22H27N5O6S/c1-15(28)23-16-4-7-19(8-5-16)34(32,33)26-12-10-17(11-13-26)24-22(29)20-14-18(27(30)31)6-9-21(20)25(2)3/h4-9,14,17H,10-13H2,1-3H3,(H,23,28)(H,24,29)