3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)carbonylamino]propanoic acid Openeye Name: 3-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-(5-thiophen-2-yl-3-isoxazolyl)methyl]amino]propanoic acid IUPAC Name: 3-[(5-thiophen-2-yl-1,2-oxazole-3-carbonyl)amino]propanoic acid Traditional Name: 3-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]propionic acid Formula: C11H10N2O4S MolecularWeight: 266.2731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)C(=O)NCCC(=O)O

InChI

InChI=1S/C11H10N2O4S/c14-10(15)3-4-12-11(16)7-6-8(17-13-7)9-2-1-5-18-9/h1-2,5-6H,3-4H2,(H,12,16)(H,14,15)