ethyl 4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-[2-(oxan-2-yloxy)ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: ethyl 4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-1-[2-(oxan-2-yloxy)ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: ethyl 4-(2-fluoro-4-iodo-anilino)-6-oxo-1-(2-tetrahydropyran-2-yloxyethyl)pyridine-3-carboxylate CAS Name: 4-(2-fluoro-4-iodoanilino)-1-[2-(2-oxanyloxy)ethyl]-6-oxo-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-fluoro-4-iodoanilino)-1-[2-(oxan-2-yloxy)ethyl]-6-oxopyridine-3-carboxylate Traditional Name: 4-(2-fluoro-4-iodo-anilino)-6-keto-1-(2-tetrahydropyran-2-yloxyethyl)nicotinic acid ethyl ester Formula: C21H24FIN2O5 MolecularWeight: 530.328533

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=O)C=C1NC2=C(C=C(C=C2)I)F)CCOC3CCCCO3

Isomeric SMILES

CCOC(=O)C1=CN(C(=O)C=C1NC2=C(C=C(C=C2)I)F)CCOC3CCCCO3

InChI

InChI=1S/C21H24FIN2O5/c1-2-28-21(27)15-13-25(8-10-30-20-5-3-4-9-29-20)19(26)12-18(15)24-17-7-6-14(23)11-16(17)22/h6-7,11-13,20,24H,2-5,8-10H2,1H3