(3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butanoate

Systemtic Name: (3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butanoate Openeye Name: (3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butanoate CAS Name: (3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butanoate IUPAC Name: (3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butanoate Traditional Name: (3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)butyrate Formula: C8H12N3O2- MolecularWeight: 182.19978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C)C(C)CC(=O)[O-]

Isomeric SMILES

CC1=NN(C(=N1)C)[C@H](C)CC(=O)[O-]

InChI

InChI=1S/C8H13N3O2/c1-5(4-8(12)13)11-7(3)9-6(2)10-11/h5H,4H2,1-3H3,(H,12,13)/p-1/t5-/m1/s1