[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-phenylbutanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-phenylbutanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C16H15BrO3S MolecularWeight: 367.2575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H15BrO3S/c1-2-12(11-6-4-3-5-7-11)16(19)20-10-13(18)14-8-9-15(17)21-14/h3-9,12H,2,10H2,1H3