methyl 4-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxybenzoate

Systemtic Name: methyl 4-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxybenzoate Openeye Name: methyl 4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxybenzoate CAS Name: 4-[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate Traditional Name: 4-(3-acetamido-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)oxybenzoic acid methyl ester Formula: C16H21NO8 MolecularWeight: 355.33984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)C(=O)OC)CO)O)O

Isomeric SMILES

CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)C(=O)OC)CO)O)O

InChI

InChI=1S/C16H21NO8/c1-8(19)17-12-14(21)13(20)11(7-18)25-16(12)24-10-5-3-9(4-6-10)15(22)23-2/h3-6,11-14,16,18,20-21H,7H2,1-2H3,(H,17,19)