2-oxidanylidene-2-[5-(4-pyridin-3-ylbutoxy)thiophen-2-yl]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[5-(4-pyridin-3-ylbutoxy)thiophen-2-yl]ethanoic acid Openeye Name: 2-oxo-2-[5-[4-(3-pyridyl)butoxy]-2-thienyl]acetic acid CAS Name: 2-oxo-2-[5-[4-(3-pyridinyl)butoxy]-2-thiophenyl]acetic acid IUPAC Name: 2-oxo-2-[5-(4-pyridin-3-ylbutoxy)thiophen-2-yl]acetic acid Traditional Name: 2-keto-2-[5-[4-(3-pyridyl)butoxy]-2-thienyl]acetic acid Formula: C15H15NO4S MolecularWeight: 305.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCOC2=CC=C(S2)C(=O)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCCOC2=CC=C(S2)C(=O)C(=O)O

InChI

InChI=1S/C15H15NO4S/c17-14(15(18)19)12-6-7-13(21-12)20-9-2-1-4-11-5-3-8-16-10-11/h3,5-8,10H,1-2,4,9H2,(H,18,19)