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

Systemtic Name: 3-[(3-fluoranyl-4-methoxy-phenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[(3-fluoro-4-methoxy-phenyl)methyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-(3-fluoro-4-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)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])F

Isomeric SMILES

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

InChI

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