3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4-[(4-methylsulfanylphenyl)methyl]-5-oxidanyl-furan-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4-[(4-methylsulfanylphenyl)methyl]-5-oxidanyl-furan-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(4-methylsulfanylphenyl)methyl]furan-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[[4-(methylthio)phenyl]methyl]-2-furanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(4-methylsulfanylphenyl)methyl]furan-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[4-(methylthio)benzyl]furan-2-one Formula: C26H22O6S MolecularWeight: 462.51428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC=C(C=C5)SC)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC=C(C=C5)SC)O

InChI

InChI=1S/C26H22O6S/c1-29-19-8-6-18(7-9-19)26(28)21(13-16-3-10-20(33-2)11-4-16)24(25(27)32-26)17-5-12-22-23(14-17)31-15-30-22/h3-12,14,28H,13,15H2,1-2H3