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

Systemtic Name: 5-[(2-methoxycarbonylthiophen-3-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(2-methoxycarbonyl-3-thienyl)amino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[(2-methoxycarbonyl-3-thiophenyl)amino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[(2-methoxycarbonylthiophen-3-yl)amino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[(2-carbomethoxy-3-thienyl)amino]-5-keto-3,3-dimethyl-valeric acid Formula: C13H17NO5S MolecularWeight: 299.34278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=C(SC=C1)C(=O)OC)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=C(SC=C1)C(=O)OC)CC(=O)O

InChI

InChI=1S/C13H17NO5S/c1-13(2,7-10(16)17)6-9(15)14-8-4-5-20-11(8)12(18)19-3/h4-5H,6-7H2,1-3H3,(H,14,15)(H,16,17)