2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 3-methyl-2-oxidanylidene-butanoic acid

Systemtic Name: 2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 3-methyl-2-oxidanylidene-butanoic acid Openeye Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 3-methyl-2-oxo-butanoic acid CAS Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 3-methyl-2-oxobutanoic acid IUPAC Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 3-methyl-2-oxobutanoic acid Traditional Name: 2-amino-3-(1H-imidazol-5-yl)propionic acid; 2-keto-3-methyl-butyric acid Formula: C11H17N3O5 MolecularWeight: 271.26978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(=O)O.C1=C(NC=N1)CC(C(=O)O)N

Isomeric SMILES

CC(C)C(=O)C(=O)O.C1=C(NC=N1)CC(C(=O)O)N

InChI

InChI=1S/C6H9N3O2.C5H8O3/c7-5(6(10)11)1-4-2-8-3-9-4;1-3(2)4(6)5(7)8/h2-3,5H,1,7H2,(H,8,9)(H,10,11);3H,1-2H3,(H,7,8)