(3R)-3-(1,2,4-triazol-1-yl)butanoate

Systemtic Name: (3R)-3-(1,2,4-triazol-1-yl)butanoate Openeye Name: (3R)-3-(1,2,4-triazol-1-yl)butanoate CAS Name: (3R)-3-(1,2,4-triazol-1-yl)butanoate IUPAC Name: (3R)-3-(1,2,4-triazol-1-yl)butanoate Traditional Name: (3R)-3-(1,2,4-triazol-1-yl)butyrate Formula: C6H8N3O2- MolecularWeight: 154.14662

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)[O-])N1C=NC=N1

Isomeric SMILES

C[C@H](CC(=O)[O-])N1C=NC=N1

InChI

InChI=1S/C6H9N3O2/c1-5(2-6(10)11)9-4-7-3-8-9/h3-5H,2H2,1H3,(H,10,11)/p-1/t5-/m1/s1