4-[2-(1,2,4-triazol-1-yl)ethanoylamino]butanoate

Systemtic Name: 4-[2-(1,2,4-triazol-1-yl)ethanoylamino]butanoate Openeye Name: 4-[[2-(1,2,4-triazol-1-yl)acetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]butanoate IUPAC Name: 4-[[2-(1,2,4-triazol-1-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(1,2,4-triazol-1-yl)acetyl]amino]butyrate Formula: C8H11N4O3- MolecularWeight: 211.19794

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)CC(=O)NCCCC(=O)[O-]

Isomeric SMILES

C1=NN(C=N1)CC(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C8H12N4O3/c13-7(4-12-6-9-5-11-12)10-3-1-2-8(14)15/h5-6H,1-4H2,(H,10,13)(H,14,15)/p-1