2-(5-acetamido-3-acetyloxy-2-aminocarbonyl-6-phenylmethoxy-oxan-4-yl)oxypropanoic acid

Systemtic Name: 2-(5-acetamido-3-acetyloxy-2-aminocarbonyl-6-phenylmethoxy-oxan-4-yl)oxypropanoic acid Openeye Name: 2-(3-acetamido-5-acetoxy-2-benzyloxy-6-carbamoyl-tetrahydropyran-4-yl)oxypropanoic acid CAS Name: 2-[(5-acetamido-3-acetyloxy-2-carbamoyl-6-phenylmethoxy-4-oxanyl)oxy]propanoic acid IUPAC Name: 2-(5-acetamido-3-acetyloxy-2-carbamoyl-6-phenylmethoxyoxan-4-yl)oxypropanoic acid Traditional Name: 2-(3-acetamido-5-acetoxy-2-benzoxy-6-carbamoyl-tetrahydropyran-4-yl)oxypropionic acid Formula: C20H26N2O9 MolecularWeight: 438.42844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1C(C(OC(C1OC(=O)C)C(=O)N)OCC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)O)OC1C(C(OC(C1OC(=O)C)C(=O)N)OCC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C20H26N2O9/c1-10(19(26)27)29-15-14(22-11(2)23)20(28-9-13-7-5-4-6-8-13)31-17(18(21)25)16(15)30-12(3)24/h4-8,10,14-17,20H,9H2,1-3H3,(H2,21,25)(H,22,23)(H,26,27)