2-ethyl-3-(hydroxymethyl)-4-(3-methylimidazol-4-yl)butanoic acid

Systemtic Name: 2-ethyl-3-(hydroxymethyl)-4-(3-methylimidazol-4-yl)butanoic acid Openeye Name: 2-ethyl-3-(hydroxymethyl)-4-(3-methylimidazol-4-yl)butanoic acid CAS Name: 2-ethyl-3-(hydroxymethyl)-4-(3-methyl-4-imidazolyl)butanoic acid IUPAC Name: 2-ethyl-3-(hydroxymethyl)-4-(3-methylimidazol-4-yl)butanoic acid Traditional Name: 2-ethyl-4-hydroxy-3-[(3-methylimidazol-4-yl)methyl]butyric acid Formula: C11H18N2O3 MolecularWeight: 226.27222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1=CN=CN1C)CO)C(=O)O

Isomeric SMILES

CCC(C(CC1=CN=CN1C)CO)C(=O)O

InChI

InChI=1S/C11H18N2O3/c1-3-10(11(15)16)8(6-14)4-9-5-12-7-13(9)2/h5,7-8,10,14H,3-4,6H2,1-2H3,(H,15,16)