2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(5-chloranyl-2-methoxy-phenyl)ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(5-chloranyl-2-methoxy-phenyl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-pyridazin-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-1-pyridazinyl]-N-(5-chloro-2-methoxyphenyl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxopyridazin-1-yl]-N-(5-chloro-2-methoxyphenyl)acetamide Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6-keto-pyridazin-1-yl]-N-(5-chloro-2-methoxy-phenyl)acetamide Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CN2C(=O)C=CC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CN2C(=O)C=CC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H16ClN3O5/c1-27-16-6-3-13(21)9-15(16)22-19(25)10-24-20(26)7-4-14(23-24)12-2-5-17-18(8-12)29-11-28-17/h2-9H,10-11H2,1H3,(H,22,25)