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

Systemtic Name: 4-[2,4,6-tris(oxidanylidene)-5-phenyl-1,3-diazinan-5-yl]butanoic acid Openeye Name: 4-(2,4,6-trioxo-5-phenyl-hexahydropyrimidin-5-yl)butanoic acid CAS Name: 4-(2,4,6-trioxo-5-phenyl-1,3-diazinan-5-yl)butanoic acid IUPAC Name: 4-(2,4,6-trioxo-5-phenyl-1,3-diazinan-5-yl)butanoic acid Traditional Name: 4-(2,4,6-triketo-5-phenyl-hexahydropyrimidin-5-yl)butyric acid Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=O)NC(=O)NC2=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(=O)NC(=O)NC2=O)CCCC(=O)O

InChI

InChI=1S/C14H14N2O5/c17-10(18)7-4-8-14(9-5-2-1-3-6-9)11(19)15-13(21)16-12(14)20/h1-3,5-6H,4,7-8H2,(H,17,18)(H2,15,16,19,20,21)