tert-butyl 2-[5-aminocarbonyl-4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-2-oxidanylidene-pyridin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[5-aminocarbonyl-4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-2-oxidanylidene-pyridin-1-yl]ethanoate Openeye Name: tert-butyl 2-[5-carbamoyl-4-(2-fluoro-4-iodo-anilino)-2-oxo-1-pyridyl]acetate CAS Name: 2-[5-carbamoyl-4-(2-fluoro-4-iodoanilino)-2-oxo-1-pyridinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-carbamoyl-4-(2-fluoro-4-iodoanilino)-2-oxopyridin-1-yl]acetate Traditional Name: 2-[5-carbamoyl-4-(2-fluoro-4-iodo-anilino)-2-keto-1-pyridyl]acetic acid tert-butyl ester Formula: C18H19FIN3O4 MolecularWeight: 487.264033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=C(C(=CC1=O)NC2=C(C=C(C=C2)I)F)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=C(C(=CC1=O)NC2=C(C=C(C=C2)I)F)C(=O)N

InChI

InChI=1S/C18H19FIN3O4/c1-18(2,3)27-16(25)9-23-8-11(17(21)26)14(7-15(23)24)22-13-5-4-10(20)6-12(13)19/h4-8,22H,9H2,1-3H3,(H2,21,26)