5-fluoranyl-3-[[3-methyl-2-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]butanoyl]amino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[[3-methyl-2-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]butanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[[2-[[2-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-methyl-butanoyl]amino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[2-[[2-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-methyl-1-oxobutyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[2-[[2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-methylbutanoyl]amino]-4-oxopentanoic acid Traditional Name: 5-fluoro-3-[[2-[[2-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]-3-methyl-butanoyl]amino]-4-keto-valeric acid Formula: C22H25FN2O8 MolecularWeight: 464.440903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C22H25FN2O8/c1-10(2)20(21(31)24-15(8-19(29)30)16(27)9-23)25-18(28)7-14-11(3)13-5-4-12(26)6-17(13)33-22(14)32/h4-6,10,15,20,26H,7-9H2,1-3H3,(H,24,31)(H,25,28)(H,29,30)