1-[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfonyl-N-(4-oxidanylcyclohexyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfonyl-N-(4-oxidanylcyclohexyl)piperidine-4-carboxamide Openeye Name: N-(4-hydroxycyclohexyl)-1-[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-hydroxycyclohexyl)-1-[2-(2-hydroxyethylamino)-5-nitrophenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-hydroxycyclohexyl)-1-[2-(2-hydroxyethylamino)-5-nitrophenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-hydroxycyclohexyl)-1-[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfonyl-isonipecotamide Formula: C20H30N4O7S MolecularWeight: 470.5398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO)O

InChI

InChI=1S/C20H30N4O7S/c25-12-9-21-18-6-3-16(24(28)29)13-19(18)32(30,31)23-10-7-14(8-11-23)20(27)22-15-1-4-17(26)5-2-15/h3,6,13-15,17,21,25-26H,1-2,4-5,7-12H2,(H,22,27)