2-(2-bromanyl-7-methyl-3-phenyl-1-benzofuran-5-yl)ethanoic acid

Systemtic Name: 2-(2-bromanyl-7-methyl-3-phenyl-1-benzofuran-5-yl)ethanoic acid Openeye Name: 2-(2-bromo-7-methyl-3-phenyl-benzofuran-5-yl)acetic acid CAS Name: 2-(2-bromo-7-methyl-3-phenyl-5-benzofuranyl)acetic acid IUPAC Name: 2-(2-bromo-7-methyl-3-phenyl-1-benzofuran-5-yl)acetic acid Traditional Name: 2-(2-bromo-7-methyl-3-phenyl-benzofuran-5-yl)acetic acid Formula: C17H13BrO3 MolecularWeight: 345.18732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CC(=O)O)C(=C(O2)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC(=C1)CC(=O)O)C(=C(O2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H13BrO3/c1-10-7-11(9-14(19)20)8-13-15(17(18)21-16(10)13)12-5-3-2-4-6-12/h2-8H,9H2,1H3,(H,19,20)