4-oxidanylidene-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]phthalazine-1-carboxylate

Systemtic Name: 4-oxidanylidene-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]phthalazine-1-carboxylate Openeye Name: 4-oxo-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]phthalazine-1-carboxylate CAS Name: 4-oxo-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-phthalazinecarboxylate IUPAC Name: 4-oxo-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]phthalazine-1-carboxylate Traditional Name: 4-keto-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]phthalazine-1-carboxylate Formula: C18H11N4O4- MolecularWeight: 347.30434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(O2)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(O2)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

InChI

InChI=1S/C18H12N4O4/c23-17-13-9-5-4-8-12(13)15(18(24)25)21-22(17)10-14-19-20-16(26-14)11-6-2-1-3-7-11/h1-9H,10H2,(H,24,25)/p-1