2-[(1-oxidanyl-1-oxidanylidene-3-thiophen-2-yl-propan-2-yl)amino]butanoic acid

Systemtic Name: 2-[(1-oxidanyl-1-oxidanylidene-3-thiophen-2-yl-propan-2-yl)amino]butanoic acid Openeye Name: 2-[[2-hydroxy-2-oxo-1-(2-thienylmethyl)ethyl]amino]butanoic acid CAS Name: 2-[(1-hydroxy-1-oxo-3-thiophen-2-ylpropan-2-yl)amino]butanoic acid IUPAC Name: 2-[(1-hydroxy-1-oxo-3-thiophen-2-ylpropan-2-yl)amino]butanoic acid Traditional Name: 2-[[2-hydroxy-2-keto-1-(2-thenyl)ethyl]amino]butyric acid Formula: C11H15NO4S MolecularWeight: 257.3061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(CC1=CC=CS1)C(=O)O

Isomeric SMILES

CCC(C(=O)O)NC(CC1=CC=CS1)C(=O)O

InChI

InChI=1S/C11H15NO4S/c1-2-8(10(13)14)12-9(11(15)16)6-7-4-3-5-17-7/h3-5,8-9,12H,2,6H2,1H3,(H,13,14)(H,15,16)