3-[3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]propanoylamino]butanoic acid

Systemtic Name: 3-[3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]propanoylamino]butanoic acid Openeye Name: 3-[3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanoylamino]butanoic acid CAS Name: 3-[[3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-[3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanoylamino]butanoic acid Traditional Name: 3-[3-(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)propanoylamino]butyric acid Formula: C12H17N3O5 MolecularWeight: 283.28048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)CCC(=O)NC(C)CC(=O)O

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)CCC(=O)NC(C)CC(=O)O

InChI

InChI=1S/C12H17N3O5/c1-6(5-10(17)18)13-9(16)4-3-8-7(2)14-12(20)15-11(8)19/h6H,3-5H2,1-2H3,(H,13,16)(H,17,18)(H2,14,15,19,20)