2-[4-[3,3-bis(3-bromophenyl)prop-2-enylsulfanyl]-3-bromanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3,3-bis(3-bromophenyl)prop-2-enylsulfanyl]-3-bromanyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[3,3-bis(3-bromophenyl)allylsulfanyl]-3-bromo-phenoxy]acetic acid CAS Name: 2-[4-[3,3-bis(3-bromophenyl)prop-2-enylthio]-3-bromophenoxy]acetic acid IUPAC Name: 2-[4-[3,3-bis(3-bromophenyl)prop-2-enylsulfanyl]-3-bromophenoxy]acetic acid Traditional Name: 2-[4-[3,3-bis(3-bromophenyl)allylthio]-3-bromo-phenoxy]acetic acid Formula: C23H17Br3O3S MolecularWeight: 613.15628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=CCSC2=C(C=C(C=C2)OCC(=O)O)Br)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=CCSC2=C(C=C(C=C2)OCC(=O)O)Br)C3=CC(=CC=C3)Br

InChI

InChI=1S/C23H17Br3O3S/c24-17-5-1-3-15(11-17)20(16-4-2-6-18(25)12-16)9-10-30-22-8-7-19(13-21(22)26)29-14-23(27)28/h1-9,11-13H,10,14H2,(H,27,28)