3-[3-(methylamino)propyl]-5-oxidanyl-2H-isoquinolin-1-one

Systemtic Name: 3-[3-(methylamino)propyl]-5-oxidanyl-2H-isoquinolin-1-one Openeye Name: 5-hydroxy-3-[3-(methylamino)propyl]-2H-isoquinolin-1-one CAS Name: 5-hydroxy-3-[3-(methylamino)propyl]-2H-isoquinolin-1-one IUPAC Name: 5-hydroxy-3-[3-(methylamino)propyl]-2H-isoquinolin-1-one Traditional Name: 5-hydroxy-3-[3-(methylamino)propyl]isocarbostyril Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1=CC2=C(C=CC=C2O)C(=O)N1

Isomeric SMILES

CNCCCC1=CC2=C(C=CC=C2O)C(=O)N1

InChI

InChI=1S/C13H16N2O2/c1-14-7-3-4-9-8-11-10(13(17)15-9)5-2-6-12(11)16/h2,5-6,8,14,16H,3-4,7H2,1H3,(H,15,17)