[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-(3,4,5-trimethoxyphenyl)ethanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-(3,4,5-trimethoxyphenyl)ethanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 2-(3,4,5-trimethoxyphenyl)acetate CAS Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 2-(3,4,5-trimethoxyphenyl)acetate Traditional Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C17H17BrO6S MolecularWeight: 429.28228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C17H17BrO6S/c1-21-12-6-10(7-13(22-2)17(12)23-3)8-16(20)24-9-11(19)14-4-5-15(18)25-14/h4-7H,8-9H2,1-3H3