6-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: 6-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: 6-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 6-bromo-3-methyl-2-benzofurancarboxylate IUPAC Name: 6-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 6-bromo-3-methyl-coumarilate Formula: C10H6BrO3- MolecularWeight: 254.05684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC(=C2)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=CC(=C2)Br)C(=O)[O-]

InChI

InChI=1S/C10H7BrO3/c1-5-7-3-2-6(11)4-8(7)14-9(5)10(12)13/h2-4H,1H3,(H,12,13)/p-1