4-azanyl-2-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-(3-fluoro-4-methoxyphenyl)-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]-4-keto-butyric acid Formula: C13H15FN2O5 MolecularWeight: 298.267003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC(CC(=O)N)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC(CC(=O)N)C(=O)O)F

InChI

InChI=1S/C13H15FN2O5/c1-21-10-3-2-7(4-8(10)14)5-12(18)16-9(13(19)20)6-11(15)17/h2-4,9H,5-6H2,1H3,(H2,15,17)(H,16,18)(H,19,20)