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

Systemtic Name: 3-[2-[2-(hydroxymethyl)-2-methyl-pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one Openeye Name: 3-[2-[2-(hydroxymethyl)-2-methyl-pyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one CAS Name: 3-[2-[2-(hydroxymethyl)-2-methyl-1-pyrrolidinyl]ethyl]-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[2-[2-(hydroxymethyl)-2-methylpyrrolidin-1-yl]ethyl]-5-methyl-2H-isoquinolin-1-one Traditional Name: 5-methyl-3-[2-(2-methyl-2-methylol-pyrrolidino)ethyl]isocarbostyril Formula: C18H24N2O2 MolecularWeight: 300.39536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)CCN3CCCC3(C)CO

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)CCN3CCCC3(C)CO

InChI

InChI=1S/C18H24N2O2/c1-13-5-3-6-15-16(13)11-14(19-17(15)22)7-10-20-9-4-8-18(20,2)12-21/h3,5-6,11,21H,4,7-10,12H2,1-2H3,(H,19,22)