4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-5-ethyl-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-5-ethyl-1,2-oxazole-3-carboxylic acid Openeye Name: 4-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]-5-ethyl-isoxazole-3-carboxylic acid CAS Name: 4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-5-ethyl-3-isoxazolecarboxylic acid IUPAC Name: 4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-5-ethyl-1,2-oxazole-3-carboxylic acid Traditional Name: 4-[(2S)-2-amino-3-hydroxy-3-keto-propyl]-5-ethyl-isoxazole-3-carboxylic acid Formula: C9H12N2O5 MolecularWeight: 228.20198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NO1)C(=O)O)CC(C(=O)O)N

Isomeric SMILES

CCC1=C(C(=NO1)C(=O)O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C9H12N2O5/c1-2-6-4(3-5(10)8(12)13)7(9(14)15)11-16-6/h5H,2-3,10H2,1H3,(H,12,13)(H,14,15)/t5-/m0/s1