2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-4,5-bis(chloranyl)pyridazin-3-one

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-4,5-bis(chloranyl)pyridazin-3-one Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-4,5-dichloro-pyridazin-3-one CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4,5-dichloro-3-pyridazinone IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4,5-dichloropyridazin-3-one Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-4,5-dichloro-pyridazin-3-one Formula: C13H8Cl2N2O4 MolecularWeight: 327.11962

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C13H8Cl2N2O4/c14-8-4-16-17(13(19)12(8)15)5-9(18)7-1-2-10-11(3-7)21-6-20-10/h1-4H,5-6H2