3-[[1-[[2,6-bis(fluoranyl)phenyl]methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]propanoic acid

Systemtic Name: 3-[[1-[[2,6-bis(fluoranyl)phenyl]methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]propanoic acid Openeye Name: 3-[[1-[(2,6-difluorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridyl]carbamoylamino]propanoic acid CAS Name: 3-[[[[1-[(2,6-difluorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-[(2,6-difluorophenyl)methyl]-2-hydroxy-4-oxopyridin-3-yl]carbamoylamino]propanoic acid Traditional Name: 3-[[1-(2,6-difluorobenzyl)-2-hydroxy-4-keto-3-pyridyl]carbamoylamino]propionic acid Formula: C16H15F2N3O5 MolecularWeight: 367.304206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O)F

InChI

InChI=1S/C16H15F2N3O5/c17-10-2-1-3-11(18)9(10)8-21-7-5-12(22)14(15(21)25)20-16(26)19-6-4-13(23)24/h1-3,5,7,25H,4,6,8H2,(H,23,24)(H2,19,20,26)