2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]methylamino]propane-1,3-diol

Systemtic Name: 2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]methylamino]propane-1,3-diol Openeye Name: 2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]phenyl]methylamino]propane-1,3-diol CAS Name: 2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]methylamino]propane-1,3-diol IUPAC Name: 2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]methylamino]propane-1,3-diol Traditional Name: 2-[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]benzyl]amino]propane-1,3-diol Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(COC3=CC=CC=C3CNC(CO)CO)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(COC3=CC=CC=C3CNC(CO)CO)O

InChI

InChI=1S/C22H30N2O4/c25-14-20(15-26)23-11-18-6-3-4-8-22(18)28-16-21(27)13-24-10-9-17-5-1-2-7-19(17)12-24/h1-8,20-21,23,25-27H,9-16H2