(4-bromanyl-1-methoxy-isoquinolin-5-yl) ethanoate

Systemtic Name: (4-bromanyl-1-methoxy-isoquinolin-5-yl) ethanoate Openeye Name: (4-bromo-1-methoxy-5-isoquinolyl) acetate CAS Name: acetic acid (4-bromo-1-methoxy-5-isoquinolinyl) ester IUPAC Name: (4-bromo-1-methoxyisoquinolin-5-yl) acetate Traditional Name: acetic acid (4-bromo-1-methoxy-5-isoquinolyl) ester Formula: C12H10BrNO3 MolecularWeight: 296.1167

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC2=C1C(=CN=C2OC)Br

Isomeric SMILES

CC(=O)OC1=CC=CC2=C1C(=CN=C2OC)Br

InChI

InChI=1S/C12H10BrNO3/c1-7(15)17-10-5-3-4-8-11(10)9(13)6-14-12(8)16-2/h3-6H,1-2H3