4-(1,2,4-triazol-1-yl)butanoate

Systemtic Name: 4-(1,2,4-triazol-1-yl)butanoate Openeye Name: 4-(1,2,4-triazol-1-yl)butanoate CAS Name: 4-(1,2,4-triazol-1-yl)butanoate IUPAC Name: 4-(1,2,4-triazol-1-yl)butanoate Traditional Name: 4-(1,2,4-triazol-1-yl)butyrate Formula: C6H8N3O2- MolecularWeight: 154.14662

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)CCCC(=O)[O-]

Isomeric SMILES

C1=NN(C=N1)CCCC(=O)[O-]

InChI

InChI=1S/C6H9N3O2/c10-6(11)2-1-3-9-5-7-4-8-9/h4-5H,1-3H2,(H,10,11)/p-1