6-(diethylamino)-6-oxidanylidene-5-thiophen-2-yl-hexanoic acid

Systemtic Name: 6-(diethylamino)-6-oxidanylidene-5-thiophen-2-yl-hexanoic acid Openeye Name: 6-(diethylamino)-6-oxo-5-(2-thienyl)hexanoic acid CAS Name: 6-(diethylamino)-6-oxo-5-thiophen-2-ylhexanoic acid IUPAC Name: 6-(diethylamino)-6-oxo-5-thiophen-2-ylhexanoic acid Traditional Name: 6-(diethylamino)-6-keto-5-(2-thienyl)hexanoic acid Formula: C14H21NO3S MolecularWeight: 283.38644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(CCCC(=O)O)C1=CC=CS1

Isomeric SMILES

CCN(CC)C(=O)C(CCCC(=O)O)C1=CC=CS1

InChI

InChI=1S/C14H21NO3S/c1-3-15(4-2)14(18)11(7-5-9-13(16)17)12-8-6-10-19-12/h6,8,10-11H,3-5,7,9H2,1-2H3,(H,16,17)