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

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 4-bromanylbenzoate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C19H16BrNO4S MolecularWeight: 434.30364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrNO4S/c1-23-16-8-5-13(9-17(16)24-2)18-21-15(11-26-18)10-25-19(22)12-3-6-14(20)7-4-12/h3-9,11H,10H2,1-2H3