ethyl 2-[3-[(2-fluoranyl-4-iodanyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(2-fluoranyl-4-iodanyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(2-fluoro-4-iodo-phenyl)methyl]-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-[(2-fluoro-4-iodophenyl)methyl]-4-oxo-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(2-fluoro-4-iodophenyl)methyl]-4-oxophthalazin-1-yl]acetate Traditional Name: 2-[3-(2-fluoro-4-iodo-benzyl)-4-keto-phthalazin-1-yl]acetic acid ethyl ester Formula: C19H16FIN2O3 MolecularWeight: 466.244813

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=C(C=C(C=C3)I)F

Isomeric SMILES

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=C(C=C(C=C3)I)F

InChI

InChI=1S/C19H16FIN2O3/c1-2-26-18(24)10-17-14-5-3-4-6-15(14)19(25)23(22-17)11-12-7-8-13(21)9-16(12)20/h3-9H,2,10-11H2,1H3