3-[[1,6-bis(fluoranyl)-5-methanoyl-cyclohexa-2,4-dien-1-yl]amino]-2-methyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[1,6-bis(fluoranyl)-5-methanoyl-cyclohexa-2,4-dien-1-yl]amino]-2-methyl-3-oxidanylidene-propanoic acid Openeye Name: 3-[(1,6-difluoro-5-formyl-cyclohexa-2,4-dien-1-yl)amino]-2-methyl-3-oxo-propanoic acid CAS Name: 3-[(1,6-difluoro-5-formyl-1-cyclohexa-2,4-dienyl)amino]-2-methyl-3-oxopropanoic acid IUPAC Name: 3-[(1,6-difluoro-5-formylcyclohexa-2,4-dien-1-yl)amino]-2-methyl-3-oxopropanoic acid Traditional Name: 3-[(1,6-difluoro-5-formyl-cyclohexa-2,4-dien-1-yl)amino]-3-keto-2-methyl-propionic acid Formula: C11H11F2NO4 MolecularWeight: 259.206146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(C=CC=C(C1F)C=O)F)C(=O)O

Isomeric SMILES

CC(C(=O)NC1(C=CC=C(C1F)C=O)F)C(=O)O

InChI

InChI=1S/C11H11F2NO4/c1-6(10(17)18)9(16)14-11(13)4-2-3-7(5-15)8(11)12/h2-6,8H,1H3,(H,14,16)(H,17,18)