2-(hydroxymethyl)-6-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]oxane-3,4,5-triol

Systemtic Name: 2-(hydroxymethyl)-6-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]oxane-3,4,5-triol Openeye Name: 2-(hydroxymethyl)-6-[7-(p-tolylmethyl)benzothiophen-2-yl]tetrahydropyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]oxane-3,4,5-triol IUPAC Name: 2-(hydroxymethyl)-6-[7-[(4-methylphenyl)methyl]-1-benzothiophen-2-yl]oxane-3,4,5-triol Traditional Name: 2-[7-(4-methylbenzyl)benzothiophen-2-yl]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C22H24O5S MolecularWeight: 400.48796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CC=CC3=C2SC(=C3)C4C(C(C(C(O4)CO)O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CC=CC3=C2SC(=C3)C4C(C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C22H24O5S/c1-12-5-7-13(8-6-12)9-14-3-2-4-15-10-17(28-22(14)15)21-20(26)19(25)18(24)16(11-23)27-21/h2-8,10,16,18-21,23-26H,9,11H2,1H3