3-[4-[2-(1,2,4-triazol-1-yl)ethanoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-(1,2,4-triazol-1-yl)ethanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(1,2,4-triazol-1-yl)acetyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-(1,2,4-triazol-1-yl)acetyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(1,2,4-triazol-1-yl)acetyl]piperazino]propionic acid Formula: C11H17N5O3 MolecularWeight: 267.28438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)CN2C=NC=N2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)CN2C=NC=N2

InChI

InChI=1S/C11H17N5O3/c17-10(7-16-9-12-8-13-16)15-5-3-14(4-6-15)2-1-11(18)19/h8-9H,1-7H2,(H,18,19)