methyl 2-[4-[3,3-bis(4-bromophenyl)prop-2-enylsulfanyl]-2-methyl-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[3,3-bis(4-bromophenyl)prop-2-enylsulfanyl]-2-methyl-phenoxy]ethanoate Openeye Name: methyl 2-[4-[3,3-bis(4-bromophenyl)allylsulfanyl]-2-methyl-phenoxy]acetate CAS Name: 2-[4-[3,3-bis(4-bromophenyl)prop-2-enylthio]-2-methylphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3,3-bis(4-bromophenyl)prop-2-enylsulfanyl]-2-methylphenoxy]acetate Traditional Name: 2-[4-[3,3-bis(4-bromophenyl)allylthio]-2-methyl-phenoxy]acetic acid methyl ester Formula: C25H22Br2O3S MolecularWeight: 562.31338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCC=C(C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)OCC(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)SCC=C(C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)OCC(=O)OC

InChI

InChI=1S/C25H22Br2O3S/c1-17-15-22(11-12-24(17)30-16-25(28)29-2)31-14-13-23(18-3-7-20(26)8-4-18)19-5-9-21(27)10-6-19/h3-13,15H,14,16H2,1-2H3