3-[2-[2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-[2-[2-(hydroxymethyl)-4-oxidanyl-pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one Openeye Name: 3-[2-[4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one CAS Name: 3-[2-[4-hydroxy-2-(hydroxymethyl)-1-pyrrolidinyl]ethyl]-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[2-[4-hydroxy-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one Traditional Name: 3-[2-(4-hydroxy-2-methylol-pyrrolidino)ethyl]-5-methyl-isocarbostyril Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)CCN3CC(CC3CO)O

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)CCN3CC(CC3CO)O

InChI

InChI=1S/C17H22N2O3/c1-11-3-2-4-15-16(11)7-12(18-17(15)22)5-6-19-9-14(21)8-13(19)10-20/h2-4,7,13-14,20-21H,5-6,8-10H2,1H3,(H,18,22)