[4-(1,3-dithiolan-2-yl)phenyl] 2-(6-methyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(6-methyl-1-benzofuran-3-yl)ethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(6-methylbenzofuran-3-yl)acetate CAS Name: 2-(6-methyl-3-benzofuranyl)acetic acid [4-(1,3-dithiolan-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl] 2-(6-methyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methylbenzofuran-3-yl)acetic acid [4-(1,3-dithiolan-2-yl)phenyl] ester Formula: C20H18O3S2 MolecularWeight: 370.48512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OC3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OC3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C20H18O3S2/c1-13-2-7-17-15(12-22-18(17)10-13)11-19(21)23-16-5-3-14(4-6-16)20-24-8-9-25-20/h2-7,10,12,20H,8-9,11H2,1H3