4,5-bis(chloranyl)-2-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Formula: C16H17Cl2N3O4 MolecularWeight: 386.22988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

COC1=C2CN(CC(C2=C(C=C1)OC)O)CN3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3O4/c1-24-12-3-4-13(25-2)14-9(12)6-20(7-11(14)22)8-21-16(23)15(18)10(17)5-19-21/h3-5,11,22H,6-8H2,1-2H3