[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 3-(phenoxymethyl)furan-2-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 3-(phenoxymethyl)furan-2-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 3-(phenoxymethyl)furan-2-carboxylate CAS Name: 3-(phenoxymethyl)-2-furancarboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 3-(phenoxymethyl)furan-2-carboxylate Traditional Name: 3-(phenoxymethyl)furan-2-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C22H20O5S2 MolecularWeight: 428.5212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3=C(C=CO3)COC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3=C(C=CO3)COC4=CC=CC=C4

InChI

InChI=1S/C22H20O5S2/c1-24-19-13-15(22-28-11-12-29-22)7-8-18(19)27-21(23)20-16(9-10-25-20)14-26-17-5-3-2-4-6-17/h2-10,13,22H,11-12,14H2,1H3