3-acetamido-4-(1,2,3-triazol-1-yl)-2-[1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-4-(1,2,3-triazol-1-yl)-2-[1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-4-(triazol-1-yl)-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-4-(1-triazolyl)-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-4-(triazol-1-yl)-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-4-(triazol-1-yl)-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C13H18N4O7 MolecularWeight: 342.30462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(C(CO)O)O)C(=O)O)N2C=CN=N2

Isomeric SMILES

CC(=O)NC1C(C=C(OC1C(C(CO)O)O)C(=O)O)N2C=CN=N2

InChI

InChI=1S/C13H18N4O7/c1-6(19)15-10-7(17-3-2-14-16-17)4-9(13(22)23)24-12(10)11(21)8(20)5-18/h2-4,7-8,10-12,18,20-21H,5H2,1H3,(H,15,19)(H,22,23)