3-(7-bromanyl-2,3-dimethyl-1-benzofuran-5-yl)pentanedioic acid

Systemtic Name: 3-(7-bromanyl-2,3-dimethyl-1-benzofuran-5-yl)pentanedioic acid Openeye Name: 3-(7-bromo-2,3-dimethyl-benzofuran-5-yl)pentanedioic acid CAS Name: 3-(7-bromo-2,3-dimethyl-5-benzofuranyl)pentanedioic acid IUPAC Name: 3-(7-bromo-2,3-dimethyl-1-benzofuran-5-yl)pentanedioic acid Traditional Name: 3-(7-bromo-2,3-dimethyl-benzofuran-5-yl)glutaric acid Formula: C15H15BrO5 MolecularWeight: 355.1806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=C(C=C12)C(CC(=O)O)CC(=O)O)Br)C

Isomeric SMILES

CC1=C(OC2=C(C=C(C=C12)C(CC(=O)O)CC(=O)O)Br)C

InChI

InChI=1S/C15H15BrO5/c1-7-8(2)21-15-11(7)3-9(4-12(15)16)10(5-13(17)18)6-14(19)20/h3-4,10H,5-6H2,1-2H3,(H,17,18)(H,19,20)