5-[(2-ethanoylthiophen-3-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-ethanoylthiophen-3-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(2-acetyl-3-thienyl)amino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[(2-acetyl-3-thiophenyl)amino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[(2-acetylthiophen-3-yl)amino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[(2-acetyl-3-thienyl)amino]-5-keto-3,3-dimethyl-valeric acid Formula: C13H17NO4S MolecularWeight: 283.34338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4S/c1-8(15)12-9(4-5-19-12)14-10(16)6-13(2,3)7-11(17)18/h4-5H,6-7H2,1-3H3,(H,14,16)(H,17,18)