6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridazin-3-one

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridazin-3-one Openeye Name: 6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-oxo-ethyl]pyridazin-3-one CAS Name: 6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-oxoethyl]-3-pyridazinone IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-oxoethyl]pyridazin-3-one Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-[2-(4-chlorophenyl)-2-keto-ethyl]pyridazin-3-one Formula: C19H13ClN2O4 MolecularWeight: 368.77052

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H13ClN2O4/c20-14-4-1-12(2-5-14)16(23)10-22-19(24)8-6-15(21-22)13-3-7-17-18(9-13)26-11-25-17/h1-9H,10-11H2