4-[3-[[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol

Systemtic Name: 4-[3-[[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[2-hydroxy-3-[[1-(4-methylsulfonylphenyl)sulfonyl-4-piperidyl]methylamino]propoxy]phenol CAS Name: 4-[2-hydroxy-3-[[1-(4-methylsulfonylphenyl)sulfonyl-4-piperidinyl]methylamino]propoxy]phenol IUPAC Name: 4-[2-hydroxy-3-[[1-(4-methylsulfonylphenyl)sulfonylpiperidin-4-yl]methylamino]propoxy]phenol Traditional Name: 4-[2-hydroxy-3-[[1-(4-mesylphenyl)sulfonyl-4-piperidyl]methylamino]propoxy]phenol Formula: C22H30N2O7S2 MolecularWeight: 498.6128

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)O)O

InChI

InChI=1S/C22H30N2O7S2/c1-32(27,28)21-6-8-22(9-7-21)33(29,30)24-12-10-17(11-13-24)14-23-15-19(26)16-31-20-4-2-18(25)3-5-20/h2-9,17,19,23,25-26H,10-16H2,1H3