[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C19H18O5S2 MolecularWeight: 390.47322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H18O5S2/c1-21-16-10-12(19-25-8-9-26-19)6-7-15(16)24-18(20)17-11-22-13-4-2-3-5-14(13)23-17/h2-7,10,17,19H,8-9,11H2,1H3/t17-/m1/s1