2-[2-(3-bromanylphenoxy)ethyl]isoquinolin-1-one

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethyl]isoquinolin-1-one Openeye Name: 2-[2-(3-bromophenoxy)ethyl]isoquinolin-1-one CAS Name: 2-[2-(3-bromophenoxy)ethyl]-1-isoquinolinone IUPAC Name: 2-[2-(3-bromophenoxy)ethyl]isoquinolin-1-one Traditional Name: 2-[2-(3-bromophenoxy)ethyl]isocarbostyril Formula: C17H14BrNO2 MolecularWeight: 344.20256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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