[2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate

Systemtic Name: [2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 3-thiophen-3-ylpropanoate Openeye Name: [2-[4-(4-bromophenyl)phenyl]-2-oxo-ethyl] 3-(3-thienyl)propanoate CAS Name: 3-(3-thiophenyl)propanoic acid [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] 3-thiophen-3-ylpropanoate Traditional Name: 3-(3-thienyl)propionic acid [2-[4-(4-bromophenyl)phenyl]-2-keto-ethyl] ester Formula: C21H17BrO3S MolecularWeight: 429.32688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)Br)C(=O)COC(=O)CCC3=CSC=C3

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)Br)C(=O)COC(=O)CCC3=CSC=C3

InChI

InChI=1S/C21H17BrO3S/c22-19-8-6-17(7-9-19)16-2-4-18(5-3-16)20(23)13-25-21(24)10-1-15-11-12-26-14-15/h2-9,11-12,14H,1,10,13H2