2-methyl-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid

Systemtic Name: 2-methyl-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid Openeye Name: 2-methyl-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid CAS Name: 2-methyl-2-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]pentanoic acid IUPAC Name: 2-methyl-2-[2-(1,2,4-triazol-1-yl)propanoylamino]pentanoic acid Traditional Name: 2-methyl-2-[2-(1,2,4-triazol-1-yl)propanoylamino]valeric acid Formula: C11H18N4O3 MolecularWeight: 254.28562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC(=O)C(C)N1C=NC=N1

Isomeric SMILES

CCCC(C)(C(=O)O)NC(=O)C(C)N1C=NC=N1

InChI

InChI=1S/C11H18N4O3/c1-4-5-11(3,10(17)18)14-9(16)8(2)15-7-12-6-13-15/h6-8H,4-5H2,1-3H3,(H,14,16)(H,17,18)