6-[(4-methoxyphenyl)-(phenylmethylsulfanyl)methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[(4-methoxyphenyl)-(phenylmethylsulfanyl)methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[benzylsulfanyl-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(4-methoxyphenyl)-(phenylmethylthio)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[benzylsulfanyl-(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(benzylthio)-(4-methoxyphenyl)methyl]sesamol Formula: C22H20O4S MolecularWeight: 380.4568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)SCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)SCC4=CC=CC=C4

InChI

InChI=1S/C22H20O4S/c1-24-17-9-7-16(8-10-17)22(27-13-15-5-3-2-4-6-15)18-11-20-21(12-19(18)23)26-14-25-20/h2-12,22-23H,13-14H2,1H3