2-[5-acetamido-2-(acetamidomethyl)-3-oxidanyl-6-phenylmethoxy-oxan-4-yl]oxypropanoic acid

Systemtic Name: 2-[5-acetamido-2-(acetamidomethyl)-3-oxidanyl-6-phenylmethoxy-oxan-4-yl]oxypropanoic acid Openeye Name: 2-[5-acetamido-2-(acetamidomethyl)-6-benzyloxy-3-hydroxy-tetrahydropyran-4-yl]oxypropanoic acid CAS Name: 2-[[5-acetamido-2-(acetamidomethyl)-3-hydroxy-6-phenylmethoxy-4-oxanyl]oxy]propanoic acid IUPAC Name: 2-[5-acetamido-2-(acetamidomethyl)-3-hydroxy-6-phenylmethoxyoxan-4-yl]oxypropanoic acid Traditional Name: 2-[5-acetamido-2-(acetamidomethyl)-6-benzoxy-3-hydroxy-tetrahydropyran-4-yl]oxypropionic acid Formula: C20H28N2O8 MolecularWeight: 424.44492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1C(C(OC(C1O)CNC(=O)C)OCC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)O)OC1C(C(OC(C1O)CNC(=O)C)OCC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C20H28N2O8/c1-11(19(26)27)29-18-16(22-13(3)24)20(28-10-14-7-5-4-6-8-14)30-15(17(18)25)9-21-12(2)23/h4-8,11,15-18,20,25H,9-10H2,1-3H3,(H,21,23)(H,22,24)(H,26,27)