3-[(5-fluoranyl-2-methoxy-phenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[(5-fluoranyl-2-methoxy-phenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[(5-fluoro-2-methoxy-phenyl)methyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[(5-fluoro-2-methoxyphenyl)methyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[(5-fluoro-2-methoxyphenyl)methyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-(5-fluoro-2-methoxy-benzyl)-4-keto-phthalazine-1-carboxylate Formula: C17H12FN2O4- MolecularWeight: 327.286583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)F)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C17H13FN2O4/c1-24-14-7-6-11(18)8-10(14)9-20-16(21)13-5-3-2-4-12(13)15(19-20)17(22)23/h2-8H,9H2,1H3,(H,22,23)/p-1