2-[2-(4-bromanylphenoxy)ethyl]isoquinolin-1-one

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethyl]isoquinolin-1-one Openeye Name: 2-[2-(4-bromophenoxy)ethyl]isoquinolin-1-one CAS Name: 2-[2-(4-bromophenoxy)ethyl]-1-isoquinolinone IUPAC Name: 2-[2-(4-bromophenoxy)ethyl]isoquinolin-1-one Traditional Name: 2-[2-(4-bromophenoxy)ethyl]isocarbostyril Formula: C17H14BrNO2 MolecularWeight: 344.20256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CCOC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrNO2/c18-14-5-7-15(8-6-14)21-12-11-19-10-9-13-3-1-2-4-16(13)17(19)20/h1-10H,11-12H2