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

Systemtic Name: 1-[3-[2-methoxy-4-[(3-methylsulfanylpropylamino)methyl]phenoxy]-2-oxidanyl-propyl]piperidin-4-ol Openeye Name: 1-[2-hydroxy-3-[2-methoxy-4-[(3-methylsulfanylpropylamino)methyl]phenoxy]propyl]piperidin-4-ol CAS Name: 1-[2-hydroxy-3-[2-methoxy-4-[[3-(methylthio)propylamino]methyl]phenoxy]propyl]-4-piperidinol IUPAC Name: 1-[2-hydroxy-3-[2-methoxy-4-[(3-methylsulfanylpropylamino)methyl]phenoxy]propyl]piperidin-4-ol Traditional Name: 1-[2-hydroxy-3-[2-methoxy-4-[[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=C(C=CC(=C1)CNCCCSC)OCC(CN2CCC(CC2)O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H34N2O4S/c1-25-20-12-16(13-21-8-3-11-27-2)4-5-19(20)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