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

Systemtic Name: 3-acetamido-2-(3-decanoyloxy-1-methoxy-2-oxidanyl-propyl)-4-(iminomethyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(3-decanoyloxy-2-hydroxy-1-methoxy-propyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[2-hydroxy-1-methoxy-3-(1-oxodecoxy)propyl]-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(3-decanoyloxy-2-hydroxy-1-methoxypropyl)-4-methanimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(3-capryloxy-2-hydroxy-1-methoxy-propyl)-4-formimidoyl-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C23H38N2O8 MolecularWeight: 470.55642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)OC)O

Isomeric SMILES

CCCCCCCCCC(=O)OCC(C(C1C(C(C=C(O1)C(=O)O)C=N)NC(=O)C)OC)O

InChI

InChI=1S/C23H38N2O8/c1-4-5-6-7-8-9-10-11-19(28)32-14-17(27)21(31-3)22-20(25-15(2)26)16(13-24)12-18(33-22)23(29)30/h12-13,16-17,20-22,24,27H,4-11,14H2,1-3H3,(H,25,26)(H,29,30)