ethyl 2-[4-(4-bromophenyl)-4-oxidanylidene-butyl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(4-bromophenyl)-4-oxidanylidene-butyl]sulfanylethanoate Openeye Name: ethyl 2-[4-(4-bromophenyl)-4-oxo-butyl]sulfanylacetate CAS Name: 2-[[4-(4-bromophenyl)-4-oxobutyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-bromophenyl)-4-oxobutyl]sulfanylacetate Traditional Name: 2-[[4-(4-bromophenyl)-4-keto-butyl]thio]acetic acid ethyl ester Formula: C14H17BrO3S MolecularWeight: 345.25198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCCC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCOC(=O)CSCCCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C14H17BrO3S/c1-2-18-14(17)10-19-9-3-4-13(16)11-5-7-12(15)8-6-11/h5-8H,2-4,9-10H2,1H3