(2S)-3-(2-ethylimidazol-1-yl)-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(2-ethylimidazol-1-yl)-2-methyl-propanoic acid Openeye Name: (2S)-3-(2-ethylimidazol-1-yl)-2-methyl-propanoic acid CAS Name: (2S)-3-(2-ethyl-1-imidazolyl)-2-methylpropanoic acid IUPAC Name: (2S)-3-(2-ethylimidazol-1-yl)-2-methylpropanoic acid Traditional Name: (2S)-3-(2-ethylimidazol-1-yl)-2-methyl-propionic acid Formula: C9H14N2O2 MolecularWeight: 182.21966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CC(C)C(=O)O

Isomeric SMILES

CCC1=NC=CN1C[C@H](C)C(=O)O

InChI

InChI=1S/C9H14N2O2/c1-3-8-10-4-5-11(8)6-7(2)9(12)13/h4-5,7H,3,6H2,1-2H3,(H,12,13)/t7-/m0/s1