(3-fluoranyl-4-methoxy-phenyl)methyl 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-(2-hydroxyethyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(2-hydroxyethyl)-4-oxo-1-phthalazinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(2-hydroxyethyl)-4-keto-phthalazine-1-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C19H17FN2O5 MolecularWeight: 372.347083

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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)CCO)F

Isomeric SMILES

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

InChI

InChI=1S/C19H17FN2O5/c1-26-16-7-6-12(10-15(16)20)11-27-19(25)17-13-4-2-3-5-14(13)18(24)22(21-17)8-9-23/h2-7,10,23H,8-9,11H2,1H3