5-[(4-oxidanidyl-1-oxidanylidene-phthalazin-2-yl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-oxidanidyl-1-oxidanylidene-phthalazin-2-yl)methyl]furan-2-carboxylate Openeye Name: 5-[(4-oxido-1-oxo-phthalazin-2-yl)methyl]furan-2-carboxylate CAS Name: 5-[(4-oxido-1-oxo-2-phthalazinyl)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-oxido-1-oxophthalazin-2-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(1-keto-4-oxido-phthalazin-2-yl)methyl]-2-furoate Formula: C14H8N2O5-2 MolecularWeight: 284.22372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(O3)C(=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(O3)C(=O)[O-])[O-]

InChI

InChI=1S/C14H10N2O5/c17-12-9-3-1-2-4-10(9)13(18)16(15-12)7-8-5-6-11(21-8)14(19)20/h1-6H,7H2,(H,15,17)(H,19,20)/p-2