5-oxidanylidene-5-(4-thiophen-2-ylbutoxy)pentanoic acid

Systemtic Name: 5-oxidanylidene-5-(4-thiophen-2-ylbutoxy)pentanoic acid Openeye Name: 5-oxo-5-[4-(2-thienyl)butoxy]pentanoic acid CAS Name: 5-oxo-5-(4-thiophen-2-ylbutoxy)pentanoic acid IUPAC Name: 5-oxo-5-(4-thiophen-2-ylbutoxy)pentanoic acid Traditional Name: 5-keto-5-[4-(2-thienyl)butoxy]valeric acid Formula: C13H18O4S MolecularWeight: 270.34462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCCOC(=O)CCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCCCOC(=O)CCCC(=O)O

InChI

InChI=1S/C13H18O4S/c14-12(15)7-3-8-13(16)17-9-2-1-5-11-6-4-10-18-11/h4,6,10H,1-3,5,7-9H2,(H,14,15)