2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-bromanyl-phenyl)ethenyl]-5-bromanyl-benzoic acid

Systemtic Name: 2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-bromanyl-phenyl)ethenyl]-5-bromanyl-benzoic acid Openeye Name: 2-[(E)-2-(4-benzo[e]benzofuran-2-yl-2-bromo-phenyl)vinyl]-5-bromo-benzoic acid CAS Name: 2-[(E)-2-[4-(2-benzo[e]benzofuranyl)-2-bromophenyl]ethenyl]-5-bromobenzoic acid IUPAC Name: 2-[(E)-2-(4-benzo[e][1]benzofuran-2-yl-2-bromophenyl)ethenyl]-5-bromobenzoic acid Traditional Name: 2-[(E)-2-(4-benzo[e]benzofuran-2-yl-2-bromo-phenyl)vinyl]-5-bromo-benzoic acid Formula: C27H16Br2O3 MolecularWeight: 548.22214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C=C(O3)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)Br)C(=O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C=C(O3)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)Br)C(=O)O)Br

InChI

InChI=1S/C27H16Br2O3/c28-20-11-9-17(22(14-20)27(30)31)5-6-18-7-8-19(13-24(18)29)26-15-23-21-4-2-1-3-16(21)10-12-25(23)32-26/h1-15H,(H,30,31)/b6-5+