ethoxycarbonyloxycarbonyl (2S,3R)-2-(4-methylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: ethoxycarbonyloxycarbonyl (2S,3R)-2-(4-methylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: ethoxycarbonyloxycarbonyl (2S,3R)-2-(p-tolyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (2S,3R)-2-(4-methylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [ethoxycarbonyloxy(oxo)methyl] ester IUPAC Name: ethoxycarbonyloxycarbonyl (2S,3R)-2-(4-methylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (2S,3R)-2-(p-tolyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid carbethoxyoxycarbonyl ester Formula: C20H18O8 MolecularWeight: 386.35212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=O)OC(=O)C1C(OC2=CC=CC=C2O1)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)OC(=O)OC(=O)[C@H]1[C@@H](OC2=CC=CC=C2O1)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H18O8/c1-3-24-19(22)28-20(23)27-18(21)17-16(13-10-8-12(2)9-11-13)25-14-6-4-5-7-15(14)26-17/h4-11,16-17H,3H2,1-2H3/t16-,17+/m0/s1