1-[2-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol

Systemtic Name: 1-[2-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol Openeye Name: 1-[2-[[5-isoquinolylmethyl(methyl)amino]methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-yl-propan-2-ol CAS Name: 1-[2-[[5-isoquinolinylmethyl(methyl)amino]methyl]-5-methoxyphenoxy]-3-(1-pyrrolidinyl)-2-propanol IUPAC Name: 1-[2-[[isoquinolin-5-ylmethyl(methyl)amino]methyl]-5-methoxyphenoxy]-3-pyrrolidin-1-ylpropan-2-ol Traditional Name: 1-[2-[[5-isoquinolylmethyl(methyl)amino]methyl]-5-methoxy-phenoxy]-3-pyrrolidino-propan-2-ol Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)OC)OCC(CN2CCCC2)O)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CN(CC1=C(C=C(C=C1)OC)OCC(CN2CCCC2)O)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C26H33N3O3/c1-28(16-21-7-5-6-20-15-27-11-10-25(20)21)17-22-8-9-24(31-2)14-26(22)32-19-23(30)18-29-12-3-4-13-29/h5-11,14-15,23,30H,3-4,12-13,16-19H2,1-2H3