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

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2,3-dihydrobenzofuran-2-carboxylate CAS Name: 2,3-dihydrobenzofuran-2-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: coumaran-2-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C19H18O4S2 MolecularWeight: 374.47382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3CC4=CC=CC=C4O3

InChI

InChI=1S/C19H18O4S2/c1-21-16-11-13(19-24-8-9-25-19)6-7-15(16)23-18(20)17-10-12-4-2-3-5-14(12)22-17/h2-7,11,17,19H,8-10H2,1H3