1-[3-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]amino]-3-oxidanylidene-propyl]-6-oxidanylidene-pyridazin-3-olate

Systemtic Name: 1-[3-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]amino]-3-oxidanylidene-propyl]-6-oxidanylidene-pyridazin-3-olate Openeye Name: 1-[3-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)anilino]-3-oxo-propyl]-6-oxo-pyridazin-3-olate CAS Name: 1-[3-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]anilino]-3-oxopropyl]-6-oxo-3-pyridazinolate IUPAC Name: 1-[3-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)anilino]-3-oxopropyl]-6-oxopyridazin-3-olate Traditional Name: 6-keto-1-[3-keto-3-[2-(piperonylcarbamoyl)anilino]propyl]pyridazin-3-olate Formula: C22H19N4O6- MolecularWeight: 435.40946

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCN4C(=O)C=CC(=N4)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCN4C(=O)C=CC(=N4)[O-]

InChI

InChI=1S/C22H20N4O6/c27-19(9-10-26-21(29)8-7-20(28)25-26)24-16-4-2-1-3-15(16)22(30)23-12-14-5-6-17-18(11-14)32-13-31-17/h1-8,11H,9-10,12-13H2,(H,23,30)(H,24,27)(H,25,28)/p-1