methyl [1,6,7-tris(chloranyl)-4-oxidanyl-isoquinolin-3-yl] carbonate

Systemtic Name: methyl [1,6,7-tris(chloranyl)-4-oxidanyl-isoquinolin-3-yl] carbonate Openeye Name: methyl (1,6,7-trichloro-4-hydroxy-3-isoquinolyl) carbonate CAS Name: carbonic acid methyl (1,6,7-trichloro-4-hydroxy-3-isoquinolinyl) ester IUPAC Name: methyl (1,6,7-trichloro-4-hydroxyisoquinolin-3-yl) carbonate Traditional Name: carbonic acid methyl (1,6,7-trichloro-4-hydroxy-3-isoquinolyl) ester Formula: C11H6Cl3NO4 MolecularWeight: 322.52864

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=C(C2=CC(=C(C=C2C(=N1)Cl)Cl)Cl)O

Isomeric SMILES

COC(=O)OC1=C(C2=CC(=C(C=C2C(=N1)Cl)Cl)Cl)O

InChI

InChI=1S/C11H6Cl3NO4/c1-18-11(17)19-10-8(16)4-2-6(12)7(13)3-5(4)9(14)15-10/h2-3,16H,1H3