2-[5-octyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethanoic acid

Systemtic Name: 2-[5-octyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethanoic acid Openeye Name: 2-(5-octyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)acetic acid CAS Name: 2-(5-octyl-2,4,6-trioxo-1,3-diazinan-5-yl)acetic acid IUPAC Name: 2-(5-octyl-2,4,6-trioxo-1,3-diazinan-5-yl)acetic acid Traditional Name: 2-(2,4,6-triketo-5-octyl-hexahydropyrimidin-5-yl)acetic acid Formula: C14H22N2O5 MolecularWeight: 298.33488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C(=O)NC(=O)NC1=O)CC(=O)O

Isomeric SMILES

CCCCCCCCC1(C(=O)NC(=O)NC1=O)CC(=O)O

InChI

InChI=1S/C14H22N2O5/c1-2-3-4-5-6-7-8-14(9-10(17)18)11(19)15-13(21)16-12(14)20/h2-9H2,1H3,(H,17,18)(H2,15,16,19,20,21)