2-(6-methoxy-7-thiophen-3-ylcarbonyl-2,3-dihydro-1-benzofuran-5-yl)ethanoic acid

Systemtic Name: 2-(6-methoxy-7-thiophen-3-ylcarbonyl-2,3-dihydro-1-benzofuran-5-yl)ethanoic acid Openeye Name: 2-[6-methoxy-7-(thiophene-3-carbonyl)-2,3-dihydrobenzofuran-5-yl]acetic acid CAS Name: 2-[6-methoxy-7-[oxo(3-thiophenyl)methyl]-2,3-dihydrobenzofuran-5-yl]acetic acid IUPAC Name: 2-[6-methoxy-7-(thiophene-3-carbonyl)-2,3-dihydro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[6-methoxy-7-(3-thenoyl)coumaran-5-yl]acetic acid Formula: C16H14O5S MolecularWeight: 318.34436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCOC2=C1C(=O)C3=CSC=C3)CC(=O)O

Isomeric SMILES

COC1=C(C=C2CCOC2=C1C(=O)C3=CSC=C3)CC(=O)O

InChI

InChI=1S/C16H14O5S/c1-20-15-11(7-12(17)18)6-9-2-4-21-16(9)13(15)14(19)10-3-5-22-8-10/h3,5-6,8H,2,4,7H2,1H3,(H,17,18)