(2S)-2-azaniumyl-3-(5-tert-butyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(5-tert-butyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoate Openeye Name: (2S)-2-azaniumyl-3-(5-tert-butyl-3-oxo-isoxazol-4-yl)propanoate CAS Name: (2S)-2-ammonio-3-(5-tert-butyl-3-oxo-4-isoxazolyl)propanoate IUPAC Name: (2S)-2-azaniumyl-3-(5-tert-butyl-3-oxo-1,2-oxazol-4-yl)propanoate Traditional Name: (2S)-2-ammonio-3-(5-tert-butyl-3-keto-4-isoxazolin-4-yl)propionate Formula: C10H16N2O4 MolecularWeight: 228.24504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=O)NO1)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)(C)C1=C(C(=O)NO1)C[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)/t6-/m0/s1