[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C20H17NO4S MolecularWeight: 367.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H17NO4S/c1-13-6-8-14(9-7-13)19-21-15(12-26-19)10-24-20(22)18-11-23-16-4-2-3-5-17(16)25-18/h2-9,12,18H,10-11H2,1H3/t18-/m1/s1