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

Systemtic Name: 4-[3-[[1-(4-butylphenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[3-[[1-(4-butylphenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]phenol CAS Name: 4-[3-[[1-(4-butylphenyl)sulfonyl-4-piperidinyl]methylamino]-2-hydroxypropoxy]phenol IUPAC Name: 4-[3-[[1-(4-butylphenyl)sulfonylpiperidin-4-yl]methylamino]-2-hydroxypropoxy]phenol Traditional Name: 4-[3-[[1-(4-butylphenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]phenol Formula: C25H36N2O5S MolecularWeight: 476.62874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)O)O

InChI

InChI=1S/C25H36N2O5S/c1-2-3-4-20-5-11-25(12-6-20)33(30,31)27-15-13-21(14-16-27)17-26-18-23(29)19-32-24-9-7-22(28)8-10-24/h5-12,21,23,26,28-29H,2-4,13-19H2,1H3