(2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-propanoic acid Openeye Name: (2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-propanoic acid CAS Name: (2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methylpropanoic acid IUPAC Name: (2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methylpropanoic acid Traditional Name: (2S)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-methyl-propionic acid Formula: C8H13N3O2 MolecularWeight: 183.20772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C)CC(C)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C8H13N3O2/c1-5(8(12)13)4-11-7(3)9-6(2)10-11/h5H,4H2,1-3H3,(H,12,13)/t5-/m0/s1