2-(methylamino)-5-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)benzamide

Systemtic Name: 2-(methylamino)-5-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)benzamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-2-(methylamino)-5-nitro-benzamide CAS Name: 2-(methylamino)-5-nitro-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]benzamide IUPAC Name: 2-(methylamino)-5-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)benzamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-2-(methylamino)-5-nitro-benzamide Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C22H28N4O6S/c1-15(2)32-21-10-8-17(33(30,31)25-11-5-4-6-12-25)14-20(21)24-22(27)18-13-16(26(28)29)7-9-19(18)23-3/h7-10,13-15,23H,4-6,11-12H2,1-3H3,(H,24,27)