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

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 1-benzofuran-2-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C18H14O3S2 MolecularWeight: 342.43196

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C18H14O3S2/c19-17(16-11-13-3-1-2-4-15(13)21-16)20-14-7-5-12(6-8-14)18-22-9-10-23-18/h1-8,11,18H,9-10H2