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

Systemtic Name: 3-acetamido-2-(1-ethoxy-2-oxidanyl-3-tetradecanoyloxy-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(1-ethoxy-2-hydroxy-3-tetradecanoyloxy-propyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[1-ethoxy-2-hydroxy-3-(1-oxotetradecoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(1-ethoxy-2-hydroxy-3-tetradecanoyloxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(1-ethoxy-2-hydroxy-3-tetradecanoyloxy-propyl)-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C28H48N2O8 MolecularWeight: 540.68932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H48N2O8/c1-4-6-7-8-9-10-11-12-13-14-15-16-24(33)37-19-22(32)26(36-5-2)27-25(30-20(3)31)21(18-29)17-23(38-27)28(34)35/h17-18,21-22,25-27,29,32H,4-16,19H2,1-3H3,(H,30,31)(H,34,35)