[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(4-bromanylphenoxy)ethanoate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C20H18BrNO5S MolecularWeight: 464.32962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)COC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)COC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C20H18BrNO5S/c1-24-17-8-3-13(9-18(17)25-2)20-22-15(12-28-20)10-27-19(23)11-26-16-6-4-14(21)5-7-16/h3-9,12H,10-11H2,1-2H3