7-chloranyl-4-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3-methyl-2H-isoquinolin-1-one

Systemtic Name: 7-chloranyl-4-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3-methyl-2H-isoquinolin-1-one Openeye Name: 7-chloro-4-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3-methyl-2H-isoquinolin-1-one CAS Name: 7-chloro-4-[[2-(hydroxymethyl)-1-pyrrolidinyl]methyl]-3-methyl-2H-isoquinolin-1-one IUPAC Name: 7-chloro-4-[[2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-3-methyl-2H-isoquinolin-1-one Traditional Name: 7-chloro-3-methyl-4-[(2-methylolpyrrolidino)methyl]isocarbostyril Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C(C=C2)Cl)C(=O)N1)CN3CCCC3CO

Isomeric SMILES

CC1=C(C2=C(C=C(C=C2)Cl)C(=O)N1)CN3CCCC3CO

InChI

InChI=1S/C16H19ClN2O2/c1-10-15(8-19-6-2-3-12(19)9-20)13-5-4-11(17)7-14(13)16(21)18-10/h4-5,7,12,20H,2-3,6,8-9H2,1H3,(H,18,21)