3-acetamido-2-(1-fluoranyl-3-propanoyloxy-2-prop-1-en-2-ylperoxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-2-(1-fluoranyl-3-propanoyloxy-2-prop-1-en-2-ylperoxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(1-fluoro-2-isopropenylperoxy-3-propanoyloxy-propyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[1-fluoro-2-(1-methylethenyldioxy)-3-(1-oxopropoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(1-fluoro-3-propanoyloxy-2-prop-1-en-2-ylperoxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(1-fluoro-2-isopropenylperoxy-3-propionyloxy-propyl)-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C18H25FN2O8 MolecularWeight: 416.398103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)OOC(=C)C

Isomeric SMILES

CCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)OOC(=C)C

InChI

InChI=1S/C18H25FN2O8/c1-5-14(23)26-8-13(29-28-9(2)3)15(19)17-16(21-10(4)22)11(7-20)6-12(27-17)18(24)25/h6-7,11,13,15-17,20H,2,5,8H2,1,3-4H3,(H,21,22)(H,24,25)