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

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

Systemtic Name:2-azanyl-3-(5-ethyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoic acid
Openeye Name:2-amino-3-(5-ethyl-3-oxo-isoxazol-4-yl)propanoic acid
CAS Name:2-amino-3-(5-ethyl-3-oxo-4-isoxazolyl)propanoic acid
IUPAC Name:2-amino-3-(5-ethyl-3-oxo-1,2-oxazol-4-yl)propanoic acid
Traditional Name:2-amino-3-(5-ethyl-3-keto-4-isoxazolin-4-yl)propionic acid
Formula: C8H12N2O4
MolecularWeight: 200.19188
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H12N2O4/c1-2-6-4(7(11)10-14-6)3-5(9)8(12)13/h5H,2-3,9H2,1H3,(H,10,11)(H,12,13)


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