[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-decylsulfanylethanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-decylsulfanylethanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-decylsulfanylacetate CAS Name: 2-(decylthio)acetic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-decylsulfanylacetate Traditional Name: 2-(decylthio)acetic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C20H29BrO3S MolecularWeight: 429.41146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSCC(=O)OCC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCCCCCCSCC(=O)OCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C20H29BrO3S/c1-2-3-4-5-6-7-8-9-14-25-16-20(23)24-15-19(22)17-10-12-18(21)13-11-17/h10-13H,2-9,14-16H2,1H3