5-[[2,4-bis(fluoranyl)-5-methoxycarbonyl-phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2,4-bis(fluoranyl)-5-methoxycarbonyl-phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2,4-difluoro-5-methoxycarbonyl-anilino)-5-oxo-pentanoic acid CAS Name: 5-(2,4-difluoro-5-methoxycarbonylanilino)-5-oxopentanoic acid IUPAC Name: 5-(2,4-difluoro-5-methoxycarbonylanilino)-5-oxopentanoic acid Traditional Name: 5-(5-carbomethoxy-2,4-difluoro-anilino)-5-keto-valeric acid Formula: C13H13F2NO5 MolecularWeight: 301.242826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCCC(=O)O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCCC(=O)O

InChI

InChI=1S/C13H13F2NO5/c1-21-13(20)7-5-10(9(15)6-8(7)14)16-11(17)3-2-4-12(18)19/h5-6H,2-4H2,1H3,(H,16,17)(H,18,19)