3-acetamido-2-(1-fluoranyl-2-oxidanyl-3-tetradecanoyloxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-2-(1-fluoranyl-2-oxidanyl-3-tetradecanoyloxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(1-fluoro-2-hydroxy-3-tetradecanoyloxy-propyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[1-fluoro-2-hydroxy-3-(1-oxotetradecoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(1-fluoro-2-hydroxy-3-tetradecanoyloxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(1-fluoro-2-hydroxy-3-tetradecanoyloxy-propyl)-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C26H43FN2O7 MolecularWeight: 514.627223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)F)O

InChI

InChI=1S/C26H43FN2O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-22(32)35-17-20(31)23(27)25-24(29-18(2)30)19(16-28)15-21(36-25)26(33)34/h15-16,19-20,23-25,28,31H,3-14,17H2,1-2H3,(H,29,30)(H,33,34)