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

Systemtic Name: 3-acetamido-2-(3-dodecanoyloxy-1-fluoranyl-2-oxidanyl-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(3-dodecanoyloxy-1-fluoro-2-hydroxy-propyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[1-fluoro-2-hydroxy-3-(1-oxododecoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(3-dodecanoyloxy-1-fluoro-2-hydroxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(1-fluoro-2-hydroxy-3-lauroyloxy-propyl)-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C24H39FN2O7 MolecularWeight: 486.574063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H39FN2O7/c1-3-4-5-6-7-8-9-10-11-12-20(30)33-15-18(29)21(25)23-22(27-16(2)28)17(14-26)13-19(34-23)24(31)32/h13-14,17-18,21-23,26,29H,3-12,15H2,1-2H3,(H,27,28)(H,31,32)