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

Systemtic Name: 2-azanyl-3-(4-octyl-3-oxidanylidene-1,2-oxazol-5-yl)propanoic acid Openeye Name: 2-amino-3-(4-octyl-3-oxo-isoxazol-5-yl)propanoic acid CAS Name: 2-amino-3-(4-octyl-3-oxo-5-isoxazolyl)propanoic acid IUPAC Name: 2-amino-3-(4-octyl-3-oxo-1,2-oxazol-5-yl)propanoic acid Traditional Name: 2-amino-3-(3-keto-4-octyl-4-isoxazolin-5-yl)propionic acid Formula: C14H24N2O4 MolecularWeight: 284.35136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(ONC1=O)CC(C(=O)O)N

Isomeric SMILES

CCCCCCCCC1=C(ONC1=O)CC(C(=O)O)N

InChI

InChI=1S/C14H24N2O4/c1-2-3-4-5-6-7-8-10-12(20-16-13(10)17)9-11(15)14(18)19/h11H,2-9,15H2,1H3,(H,16,17)(H,18,19)