2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]butanoic acid

Systemtic Name: 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]butanoic acid Openeye Name: 2-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]butanoic acid CAS Name: 2-[[3-(3,5-dimethyl-4-isoxazolyl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]butanoic acid Traditional Name: 2-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]butyric acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CCC1=C(ON=C1C)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)CCC1=C(ON=C1C)C

InChI

InChI=1S/C12H18N2O4/c1-4-10(12(16)17)13-11(15)6-5-9-7(2)14-18-8(9)3/h10H,4-6H2,1-3H3,(H,13,15)(H,16,17)