[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: [2-(2-methoxyphenyl)thiazol-4-yl]methyl 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid [2-(2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid [2-(2-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H19NO5S MolecularWeight: 397.44426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=CS2)COC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=CS2)COC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H19NO5S/c1-24-17-5-3-2-4-16(17)21-22-15(12-28-21)11-25-20(23)9-7-14-6-8-18-19(10-14)27-13-26-18/h2-6,8,10,12H,7,9,11,13H2,1H3