3-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]propanoic acid

Systemtic Name: 3-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]propanoic acid Openeye Name: 3-[[3-acetamido-3-(2-thienyl)propanoyl]amino]propanoic acid CAS Name: 3-[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)amino]propanoic acid IUPAC Name: 3-[(3-acetamido-3-thiophen-2-ylpropanoyl)amino]propanoic acid Traditional Name: 3-[[3-acetamido-3-(2-thienyl)propanoyl]amino]propionic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCCC(=O)O)C1=CC=CS1

Isomeric SMILES

CC(=O)NC(CC(=O)NCCC(=O)O)C1=CC=CS1

InChI

InChI=1S/C12H16N2O4S/c1-8(15)14-9(10-3-2-6-19-10)7-11(16)13-5-4-12(17)18/h2-3,6,9H,4-5,7H2,1H3,(H,13,16)(H,14,15)(H,17,18)