3-methyl-2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-(2-oxo-1-pyrimidinyl)ethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]pentanoic acid Traditional Name: 2-[[2-(2-ketopyrimidin-1-yl)acetyl]amino]-3-methyl-valeric acid Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CN1C=CC=NC1=O

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CN1C=CC=NC1=O

InChI

InChI=1S/C12H17N3O4/c1-3-8(2)10(11(17)18)14-9(16)7-15-6-4-5-13-12(15)19/h4-6,8,10H,3,7H2,1-2H3,(H,14,16)(H,17,18)