3-azanyl-3-(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoic acid hydrobromide

Systemtic Name: 3-azanyl-3-(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoic acid hydrobromide Openeye Name: 3-amino-3-(5-methyl-3-oxo-isoxazol-4-yl)propanoic acid hydrobromide CAS Name: 3-amino-3-(5-methyl-3-oxo-4-isoxazolyl)propanoic acid hydrobromide IUPAC Name: 3-amino-3-(5-methyl-3-oxo-1,2-oxazol-4-yl)propanoic acid hydrobromide Traditional Name: 3-amino-3-(3-keto-5-methyl-4-isoxazolin-4-yl)propionic acid hydrobromide Formula: C7H11BrN2O4 MolecularWeight: 267.07724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NO1)C(CC(=O)O)N.Br

Isomeric SMILES

CC1=C(C(=O)NO1)C(CC(=O)O)N.Br

InChI

InChI=1S/C7H10N2O4.BrH/c1-3-6(7(12)9-13-3)4(8)2-5(10)11;/h4H,2,8H2,1H3,(H,9,12)(H,10,11);1H