4-[4-(dimethylaminomethyl)phenyl]-5-oxidanyl-2H-isoquinolin-1-one hydrobromide

Systemtic Name: 4-[4-(dimethylaminomethyl)phenyl]-5-oxidanyl-2H-isoquinolin-1-one hydrobromide Openeye Name: 4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-2H-isoquinolin-1-one hydrobromide CAS Name: 4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-2H-isoquinolin-1-one hydrobromide IUPAC Name: 4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-2H-isoquinolin-1-one hydrobromide Traditional Name: 4-[4-(dimethylaminomethyl)phenyl]-5-hydroxy-isocarbostyril hydrobromide Formula: C18H19BrN2O2 MolecularWeight: 375.25966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)C2=CNC(=O)C3=C2C(=CC=C3)O.Br

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)C2=CNC(=O)C3=C2C(=CC=C3)O.Br

InChI

InChI=1S/C18H18N2O2.BrH/c1-20(2)11-12-6-8-13(9-7-12)15-10-19-18(22)14-4-3-5-16(21)17(14)15;/h3-10,21H,11H2,1-2H3,(H,19,22);1H