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

Systemtic Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(methylamino)-5-nitro-benzamide Openeye Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-2-(methylamino)-5-nitro-benzamide CAS Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(methylamino)-5-nitrobenzamide Traditional Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-2-(methylamino)-5-nitro-benzamide Formula: C21H25N5O6S MolecularWeight: 475.5181

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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-])NC

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O6S/c1-14(27)23-15-3-6-18(7-4-15)33(31,32)25-11-9-16(10-12-25)24-21(28)19-13-17(26(29)30)5-8-20(19)22-2/h3-8,13,16,22H,9-12H2,1-2H3,(H,23,27)(H,24,28)