[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C24H20O4S2 MolecularWeight: 436.5432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C24H20O4S2/c1-26-21-12-16(24-29-10-11-30-24)7-8-19(21)28-22(25)13-17-14-27-20-9-6-15-4-2-3-5-18(15)23(17)20/h2-9,12,14,24H,10-11,13H2,1H3