5-chloranyl-3,6-dimethyl-1-benzofuran-2-carboxylate

Systemtic Name: 5-chloranyl-3,6-dimethyl-1-benzofuran-2-carboxylate Openeye Name: 5-chloro-3,6-dimethyl-benzofuran-2-carboxylate CAS Name: 5-chloro-3,6-dimethyl-2-benzofurancarboxylate IUPAC Name: 5-chloro-3,6-dimethyl-1-benzofuran-2-carboxylate Traditional Name: 5-chloro-3,6-dimethyl-coumarilate Formula: C11H8ClO3- MolecularWeight: 223.63242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(OC2=C1)C(=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C(OC2=C1)C(=O)[O-])C)Cl

InChI

InChI=1S/C11H9ClO3/c1-5-3-9-7(4-8(5)12)6(2)10(15-9)11(13)14/h3-4H,1-2H3,(H,13,14)/p-1