5-(3-azanylpropoxy)-2H-isoquinolin-1-one

Systemtic Name: 5-(3-azanylpropoxy)-2H-isoquinolin-1-one Openeye Name: 5-(3-aminopropoxy)-2H-isoquinolin-1-one CAS Name: 5-(3-aminopropoxy)-2H-isoquinolin-1-one IUPAC Name: 5-(3-aminopropoxy)-2H-isoquinolin-1-one Traditional Name: 5-(3-aminopropoxy)isocarbostyril Formula: C12H14N2O2 MolecularWeight: 218.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CNC2=O)C(=C1)OCCCN

Isomeric SMILES

C1=CC2=C(C=CNC2=O)C(=C1)OCCCN

InChI

InChI=1S/C12H14N2O2/c13-6-2-8-16-11-4-1-3-10-9(11)5-7-14-12(10)15/h1,3-5,7H,2,6,8,13H2,(H,14,15)