1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]methylamino]methyl]cyclohexan-1-ol

Systemtic Name: 1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]methylamino]methyl]cyclohexan-1-ol Openeye Name: 1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]phenyl]methylamino]methyl]cyclohexanol CAS Name: 1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]methylamino]methyl]-1-cyclohexanol IUPAC Name: 1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]methylamino]methyl]cyclohexan-1-ol Traditional Name: 1-[[[2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]benzyl]amino]methyl]cyclohexanol Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNCC2=CC=CC=C2OCC(CN3CCC4=CC=CC=C4C3)O)O

Isomeric SMILES

C1CCC(CC1)(CNCC2=CC=CC=C2OCC(CN3CCC4=CC=CC=C4C3)O)O

InChI

InChI=1S/C26H36N2O3/c29-24(18-28-15-12-21-8-2-3-10-23(21)17-28)19-31-25-11-5-4-9-22(25)16-27-20-26(30)13-6-1-7-14-26/h2-5,8-11,24,27,29-30H,1,6-7,12-20H2