4,5-bis(chloranyl)-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pyridazin-3-one Formula: C18H21Cl2N3O3 MolecularWeight: 398.28364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)CN3C(=O)C(=C(C=N3)Cl)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)CN3C(=O)C(=C(C=N3)Cl)Cl)OCC

InChI

InChI=1S/C18H21Cl2N3O3/c1-3-25-15-7-12-5-6-22(10-13(12)8-16(15)26-4-2)11-23-18(24)17(20)14(19)9-21-23/h7-9H,3-6,10-11H2,1-2H3