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

Systemtic Name: 3-(2-isoquinolin-1-ylphenoxy)propane-1,2-diol Openeye Name: 3-[2-(1-isoquinolyl)phenoxy]propane-1,2-diol CAS Name: 3-[2-(1-isoquinolinyl)phenoxy]propane-1,2-diol IUPAC Name: 3-(2-isoquinolin-1-ylphenoxy)propane-1,2-diol Traditional Name: 3-[2-(1-isoquinolyl)phenoxy]propane-1,2-diol Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO3/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