7-[2-(1,2,4-triazol-1-yl)propanoylamino]heptanoic acid

Systemtic Name: 7-[2-(1,2,4-triazol-1-yl)propanoylamino]heptanoic acid Openeye Name: 7-[2-(1,2,4-triazol-1-yl)propanoylamino]heptanoic acid CAS Name: 7-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]heptanoic acid IUPAC Name: 7-[2-(1,2,4-triazol-1-yl)propanoylamino]heptanoic acid Traditional Name: 7-[2-(1,2,4-triazol-1-yl)propanoylamino]enanthic acid Formula: C12H20N4O3 MolecularWeight: 268.3122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4O3/c1-10(16-9-13-8-15-16)12(19)14-7-5-3-2-4-6-11(17)18/h8-10H,2-7H2,1H3,(H,14,19)(H,17,18)