5-methyl-2-[3-(3-oxidanylpyrrolidin-1-yl)propyl]isoquinolin-1-one

Systemtic Name: 5-methyl-2-[3-(3-oxidanylpyrrolidin-1-yl)propyl]isoquinolin-1-one Openeye Name: 2-[3-(3-hydroxypyrrolidin-1-yl)propyl]-5-methyl-isoquinolin-1-one CAS Name: 2-[3-(3-hydroxy-1-pyrrolidinyl)propyl]-5-methyl-1-isoquinolinone IUPAC Name: 2-[3-(3-hydroxypyrrolidin-1-yl)propyl]-5-methylisoquinolin-1-one Traditional Name: 2-[3-(3-hydroxypyrrolidino)propyl]-5-methyl-isocarbostyril Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=CN(C2=O)CCCN3CCC(C3)O

Isomeric SMILES

CC1=CC=CC2=C1C=CN(C2=O)CCCN3CCC(C3)O

InChI

InChI=1S/C17H22N2O2/c1-13-4-2-5-16-15(13)7-11-19(17(16)21)9-3-8-18-10-6-14(20)12-18/h2,4-5,7,11,14,20H,3,6,8-10,12H2,1H3