3-(1,3-benzodioxol-5-ylmethyl)-4-[3-[3-(diethylamino)propylamino]-2-oxidanyl-propoxy]butan-1-ol

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-[3-[3-(diethylamino)propylamino]-2-oxidanyl-propoxy]butan-1-ol Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-[3-[3-(diethylamino)propylamino]-2-hydroxy-propoxy]butan-1-ol CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-[3-[3-(diethylamino)propylamino]-2-hydroxypropoxy]-1-butanol IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-[3-[3-(diethylamino)propylamino]-2-hydroxypropoxy]butan-1-ol Traditional Name: 4-(1,3-benzodioxol-5-yl)-3-[[3-[3-(diethylamino)propylamino]-2-hydroxy-propoxy]methyl]butan-1-ol Formula: C22H38N2O5 MolecularWeight: 410.54752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNCC(COCC(CCO)CC1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

CCN(CC)CCCNCC(COCC(CCO)CC1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C22H38N2O5/c1-3-24(4-2)10-5-9-23-14-20(26)16-27-15-19(8-11-25)12-18-6-7-21-22(13-18)29-17-28-21/h6-7,13,19-20,23,25-26H,3-5,8-12,14-17H2,1-2H3