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

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-benzyl-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-(phenylmethyl)-1-phthalazinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-benzyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-benzyl-4-keto-phthalazine-1-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C24H19FN2O4 MolecularWeight: 418.417063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)F

InChI

InChI=1S/C24H19FN2O4/c1-30-21-12-11-17(13-20(21)25)15-31-24(29)22-18-9-5-6-10-19(18)23(28)27(26-22)14-16-7-3-2-4-8-16/h2-13H,14-15H2,1H3