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

Systemtic Name: 7-chloranyl-3-ethyl-4-[(3-oxidanylpyrrolidin-1-yl)methyl]-2H-isoquinolin-1-one Openeye Name: 7-chloro-3-ethyl-4-[(3-hydroxypyrrolidin-1-yl)methyl]-2H-isoquinolin-1-one CAS Name: 7-chloro-3-ethyl-4-[(3-hydroxy-1-pyrrolidinyl)methyl]-2H-isoquinolin-1-one IUPAC Name: 7-chloro-3-ethyl-4-[(3-hydroxypyrrolidin-1-yl)methyl]-2H-isoquinolin-1-one Traditional Name: 7-chloro-3-ethyl-4-[(3-hydroxypyrrolidino)methyl]isocarbostyril Formula: C16H19ClN2O2 MolecularWeight: 306.78726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)Cl)C(=O)N1)CN3CCC(C3)O

Isomeric SMILES

CCC1=C(C2=C(C=C(C=C2)Cl)C(=O)N1)CN3CCC(C3)O

InChI

InChI=1S/C16H19ClN2O2/c1-2-15-14(9-19-6-5-11(20)8-19)12-4-3-10(17)7-13(12)16(21)18-15/h3-4,7,11,20H,2,5-6,8-9H2,1H3,(H,18,21)