3-[6,7-bis(bromanyl)-2,3-dihydro-1-benzofuran-5-yl]-2-phenyl-propanoic acid

Systemtic Name: 3-[6,7-bis(bromanyl)-2,3-dihydro-1-benzofuran-5-yl]-2-phenyl-propanoic acid Openeye Name: 3-(6,7-dibromo-2,3-dihydrobenzofuran-5-yl)-2-phenyl-propanoic acid CAS Name: 3-(6,7-dibromo-2,3-dihydrobenzofuran-5-yl)-2-phenylpropanoic acid IUPAC Name: 3-(6,7-dibromo-2,3-dihydro-1-benzofuran-5-yl)-2-phenylpropanoic acid Traditional Name: 3-(6,7-dibromocoumaran-5-yl)-2-phenyl-propionic acid Formula: C17H14Br2O3 MolecularWeight: 426.09926

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=C(C=C21)CC(C3=CC=CC=C3)C(=O)O)Br)Br

Isomeric SMILES

C1COC2=C(C(=C(C=C21)CC(C3=CC=CC=C3)C(=O)O)Br)Br

InChI

InChI=1S/C17H14Br2O3/c18-14-12(8-11-6-7-22-16(11)15(14)19)9-13(17(20)21)10-4-2-1-3-5-10/h1-5,8,13H,6-7,9H2,(H,20,21)