6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyridazin-3-olate

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyridazin-3-olate Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyridazin-3-olate CAS Name: 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyridazin-3-olate Traditional Name: 6-(4-piperonylpiperazine-1-carbonyl)pyridazin-3-olate Formula: C17H17N4O4- MolecularWeight: 341.34128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=NN=C(C=C4)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=NN=C(C=C4)[O-]

InChI

InChI=1S/C17H18N4O4/c22-16-4-2-13(18-19-16)17(23)21-7-5-20(6-8-21)10-12-1-3-14-15(9-12)25-11-24-14/h1-4,9H,5-8,10-11H2,(H,19,22)/p-1