N-methyl-4-nitro-N-[4-[4-(4-oxidanylpiperidin-1-yl)butoxy]cyclohexyl]benzenesulfonamide

Systemtic Name: N-methyl-4-nitro-N-[4-[4-(4-oxidanylpiperidin-1-yl)butoxy]cyclohexyl]benzenesulfonamide Openeye Name: N-[4-[4-(4-hydroxy-1-piperidyl)butoxy]cyclohexyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[4-[4-(4-hydroxy-1-piperidinyl)butoxy]cyclohexyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[4-[4-(4-hydroxypiperidin-1-yl)butoxy]cyclohexyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[4-[4-(4-hydroxypiperidino)butoxy]cyclohexyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C22H35N3O6S MolecularWeight: 469.5948

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(CC1)OCCCCN2CCC(CC2)O)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCC(CC1)OCCCCN2CCC(CC2)O)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H35N3O6S/c1-23(32(29,30)22-10-6-19(7-11-22)25(27)28)18-4-8-21(9-5-18)31-17-3-2-14-24-15-12-20(26)13-16-24/h6-7,10-11,18,20-21,26H,2-5,8-9,12-17H2,1H3