N-(2-methoxy-5-nitro-phenyl)-4-methyl-N-(2-oxidanyl-3-piperidin-1-yl-propyl)benzenesulfonamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4-methyl-N-(2-oxidanyl-3-piperidin-1-yl-propyl)benzenesulfonamide Openeye Name: N-[2-hydroxy-3-(1-piperidyl)propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-[2-hydroxy-3-(1-piperidinyl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide Traditional Name: N-(2-hydroxy-3-piperidino-propyl)-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCCCC2)O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCCCC2)O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H29N3O6S/c1-17-6-9-20(10-7-17)32(29,30)24(16-19(26)15-23-12-4-3-5-13-23)21-14-18(25(27)28)8-11-22(21)31-2/h6-11,14,19,26H,3-5,12-13,15-16H2,1-2H3