3-(2-isoquinolin-1-ylphenoxy)propane-1,2-diol dihydrochloride

Systemtic Name: 3-(2-isoquinolin-1-ylphenoxy)propane-1,2-diol dihydrochloride Openeye Name: 3-[2-(1-isoquinolyl)phenoxy]propane-1,2-diol dihydrochloride CAS Name: 3-[2-(1-isoquinolinyl)phenoxy]propane-1,2-diol dihydrochloride IUPAC Name: 3-(2-isoquinolin-1-ylphenoxy)propane-1,2-diol dihydrochloride Traditional Name: 3-[2-(1-isoquinolyl)phenoxy]propane-1,2-diol dihydrochloride Formula: C18H19Cl2NO3 MolecularWeight: 368.25436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2C3=CC=CC=C3OCC(CO)O.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2C3=CC=CC=C3OCC(CO)O.Cl.Cl

InChI

InChI=1S/C18H17NO3.2ClH/c20-11-14(21)12-22-17-8-4-3-7-16(17)18-15-6-2-1-5-13(15)9-10-19-18;;/h1-10,14,20-21H,11-12H2;2*1H