3-[3-[2-(hydroxymethyl)pyrrolidin-1-yl]propyl]-2H-isoquinolin-1-one

Systemtic Name: 3-[3-[2-(hydroxymethyl)pyrrolidin-1-yl]propyl]-2H-isoquinolin-1-one Openeye Name: 3-[3-[2-(hydroxymethyl)pyrrolidin-1-yl]propyl]-2H-isoquinolin-1-one CAS Name: 3-[3-[2-(hydroxymethyl)-1-pyrrolidinyl]propyl]-2H-isoquinolin-1-one IUPAC Name: 3-[3-[2-(hydroxymethyl)pyrrolidin-1-yl]propyl]-2H-isoquinolin-1-one Traditional Name: 3-[3-(2-methylolpyrrolidino)propyl]isocarbostyril Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CCCC2=CC3=CC=CC=C3C(=O)N2)CO

Isomeric SMILES

C1CC(N(C1)CCCC2=CC3=CC=CC=C3C(=O)N2)CO

InChI

InChI=1S/C17H22N2O2/c20-12-15-7-4-10-19(15)9-3-6-14-11-13-5-1-2-8-16(13)17(21)18-14/h1-2,5,8,11,15,20H,3-4,6-7,9-10,12H2,(H,18,21)