2-[3-[(6,7-dimethoxyisoquinolin-1-yl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate

Systemtic Name: 2-[3-[(6,7-dimethoxyisoquinolin-1-yl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate Openeye Name: 2-[3-[(6,7-dimethoxy-1-isoquinolyl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate CAS Name: 2-[3-[(6,7-dimethoxy-1-isoquinolinyl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate IUPAC Name: 2-[3-[(6,7-dimethoxyisoquinolin-1-yl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate Traditional Name: 2-[3-[(6,7-dimethoxy-1-isoquinolyl)amino]propyl-(2-hydroxyethyl)amino]ethanol dinitrate Formula: C18H27N5O10-2 MolecularWeight: 473.43448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2NCCCN(CCO)CCO)OC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2NCCCN(CCO)CCO)OC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C18H27N3O4.2NO3/c1-24-16-12-14-4-6-20-18(15(14)13-17(16)25-2)19-5-3-7-21(8-10-22)9-11-23;2*2-1(3)4/h4,6,12-13,22-23H,3,5,7-11H2,1-2H3,(H,19,20);;/q;2*-1