2-(3-acetamido-1H-1,2,4-triazol-5-yl)ethanoic acid

Systemtic Name: 2-(3-acetamido-1H-1,2,4-triazol-5-yl)ethanoic acid Openeye Name: 2-(3-acetamido-1H-1,2,4-triazol-5-yl)acetic acid CAS Name: 2-(3-acetamido-1H-1,2,4-triazol-5-yl)acetic acid IUPAC Name: 2-(3-acetamido-1H-1,2,4-triazol-5-yl)acetic acid Traditional Name: 2-(3-acetamido-1H-1,2,4-triazol-5-yl)acetic acid Formula: C6H8N4O3 MolecularWeight: 184.15272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NNC(=N1)CC(=O)O

Isomeric SMILES

CC(=O)NC1=NNC(=N1)CC(=O)O

InChI

InChI=1S/C6H8N4O3/c1-3(11)7-6-8-4(9-10-6)2-5(12)13/h2H2,1H3,(H,12,13)(H2,7,8,9,10,11)