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

Systemtic Name: 3-[3-(hydroxymethyl)piperidin-1-yl]-2H-isoquinolin-1-one Openeye Name: 3-[3-(hydroxymethyl)-1-piperidyl]-2H-isoquinolin-1-one CAS Name: 3-[3-(hydroxymethyl)-1-piperidinyl]-2H-isoquinolin-1-one IUPAC Name: 3-[3-(hydroxymethyl)piperidin-1-yl]-2H-isoquinolin-1-one Traditional Name: 3-(3-methylolpiperidino)isocarbostyril Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC3=CC=CC=C3C(=O)N2)CO

Isomeric SMILES

C1CC(CN(C1)C2=CC3=CC=CC=C3C(=O)N2)CO

InChI

InChI=1S/C15H18N2O2/c18-10-11-4-3-7-17(9-11)14-8-12-5-1-2-6-13(12)15(19)16-14/h1-2,5-6,8,11,18H,3-4,7,9-10H2,(H,16,19)