O4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl] ester O1-methyl ester IUPAC Name: 4-O-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl] ester O1-methyl ester Formula: C20H16BrNO5S MolecularWeight: 462.31374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16BrNO5S/c1-25-17-8-7-14(21)9-16(17)18-22-15(11-28-18)10-27-20(24)13-5-3-12(4-6-13)19(23)26-2/h3-9,11H,10H2,1-2H3