6-[2-(1,2,4-triazol-1-yl)propanoylamino]hexanoic acid

Systemtic Name: 6-[2-(1,2,4-triazol-1-yl)propanoylamino]hexanoic acid Openeye Name: 6-[2-(1,2,4-triazol-1-yl)propanoylamino]hexanoic acid CAS Name: 6-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]hexanoic acid IUPAC Name: 6-[2-(1,2,4-triazol-1-yl)propanoylamino]hexanoic acid Traditional Name: 6-[2-(1,2,4-triazol-1-yl)propanoylamino]hexanoic acid Formula: C11H18N4O3 MolecularWeight: 254.28562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCCCC(=O)O)N1C=NC=N1

Isomeric SMILES

CC(C(=O)NCCCCCC(=O)O)N1C=NC=N1

InChI

InChI=1S/C11H18N4O3/c1-9(15-8-12-7-14-15)11(18)13-6-4-2-3-5-10(16)17/h7-9H,2-6H2,1H3,(H,13,18)(H,16,17)