2-[4-[2-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[1-oxo-2-(1,2,4-triazol-1-yl)propyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(1,2,4-triazol-1-yl)propanoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-(1,2,4-triazol-1-yl)propanoyl]piperazino]acetic acid Formula: C11H17N5O3 MolecularWeight: 267.28438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC(=O)O)N2C=NC=N2

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC(=O)O)N2C=NC=N2

InChI

InChI=1S/C11H17N5O3/c1-9(16-8-12-7-13-16)11(19)15-4-2-14(3-5-15)6-10(17)18/h7-9H,2-6H2,1H3,(H,17,18)