9-bromanyl-6-[2-(pyridin-3-ylamino)ethyl]-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 9-bromanyl-6-[2-(pyridin-3-ylamino)ethyl]-2H-benzo[h]isoquinolin-1-one Openeye Name: 9-bromo-6-[2-(3-pyridylamino)ethyl]-2H-benzo[h]isoquinolin-1-one CAS Name: 9-bromo-6-[2-(3-pyridinylamino)ethyl]-2H-benzo[h]isoquinolin-1-one IUPAC Name: 9-bromo-6-[2-(pyridin-3-ylamino)ethyl]-2H-benzo[h]isoquinolin-1-one Traditional Name: 9-bromo-6-[2-(3-pyridylamino)ethyl]-2H-benz[h]isoquinolin-1-one Formula: C20H16BrN3O MolecularWeight: 394.26454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NCCC2=C3C=CC(=CC3=C4C(=C2)C=CNC4=O)Br

Isomeric SMILES

C1=CC(=CN=C1)NCCC2=C3C=CC(=CC3=C4C(=C2)C=CNC4=O)Br

InChI

InChI=1S/C20H16BrN3O/c21-15-3-4-17-13(5-8-23-16-2-1-7-22-12-16)10-14-6-9-24-20(25)19(14)18(17)11-15/h1-4,6-7,9-12,23H,5,8H2,(H,24,25)