[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C20H20O5S3 MolecularWeight: 436.5648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H20O5S3/c1-22-17-10-13(20-26-8-9-27-20)2-4-16(17)25-19(21)12-28-14-3-5-15-18(11-14)24-7-6-23-15/h2-5,10-11,20H,6-9,12H2,1H3