1-[(2R)-3-[4-methoxy-2-[(3-methylsulfanylpropylamino)methyl]phenoxy]-2-oxidanyl-propyl]piperidin-4-ol

Systemtic Name: 1-[(2R)-3-[4-methoxy-2-[(3-methylsulfanylpropylamino)methyl]phenoxy]-2-oxidanyl-propyl]piperidin-4-ol Openeye Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(3-methylsulfanylpropylamino)methyl]phenoxy]propyl]piperidin-4-ol CAS Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[[3-(methylthio)propylamino]methyl]phenoxy]propyl]-4-piperidinol IUPAC Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[(3-methylsulfanylpropylamino)methyl]phenoxy]propyl]piperidin-4-ol Traditional Name: 1-[(2R)-2-hydroxy-3-[4-methoxy-2-[[3-(methylthio)propylamino]methyl]phenoxy]propyl]piperidin-4-ol Formula: C20H34N2O4S MolecularWeight: 398.55996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(CN2CCC(CC2)O)O)CNCCCSC

Isomeric SMILES

COC1=CC(=C(C=C1)OC[C@@H](CN2CCC(CC2)O)O)CNCCCSC

InChI

InChI=1S/C20H34N2O4S/c1-25-19-4-5-20(16(12-19)13-21-8-3-11-27-2)26-15-18(24)14-22-9-6-17(23)7-10-22/h4-5,12,17-18,21,23-24H,3,6-11,13-15H2,1-2H3/t18-/m1/s1