4-[2-(4,6-dimethyl-2-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(4,6-dimethyl-2-oxidanylidene-1H-pyrimidin-5-yl)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetyl]amino]butanoic acid CAS Name: 4-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(2-keto-4,6-dimethyl-1H-pyrimidin-5-yl)acetyl]amino]butyric acid Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O4/c1-7-9(8(2)15-12(19)14-7)6-10(16)13-5-3-4-11(17)18/h3-6H2,1-2H3,(H,13,16)(H,17,18)(H,14,15,19)