phenacyl 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: phenacyl 2-(4-bromophenyl)sulfanylethanoate Openeye Name: phenacyl 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid phenacyl ester IUPAC Name: phenacyl 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid phenacyl ester Formula: C16H13BrO3S MolecularWeight: 365.24162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H13BrO3S/c17-13-6-8-14(9-7-13)21-11-16(19)20-10-15(18)12-4-2-1-3-5-12/h1-9H,10-11H2