(3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-5-methoxy-6-sulfanyl-2,3-dihydro-1-benzofuran-2-yl]butan-2-ol

Systemtic Name: (3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-5-methoxy-6-sulfanyl-2,3-dihydro-1-benzofuran-2-yl]butan-2-ol Openeye Name: (3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-5-methoxy-6-sulfanyl-2,3-dihydrobenzofuran-2-yl]butan-2-ol CAS Name: (3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-6-mercapto-5-methoxy-2,3-dihydrobenzofuran-2-yl]-2-butanol IUPAC Name: (3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-5-methoxy-6-sulfanyl-2,3-dihydro-1-benzofuran-2-yl]butan-2-ol Traditional Name: (3R)-3-(1,3-benzodioxol-5-yl)-4-[(2S)-6-mercapto-5-methoxy-coumaran-2-yl]butan-2-ol Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1CC2=CC(=C(C=C2O1)S)OC)C3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CC([C@H](C[C@H]1CC2=CC(=C(C=C2O1)S)OC)C3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C20H22O5S/c1-11(21)15(12-3-4-16-18(6-12)24-10-23-16)8-14-5-13-7-19(22-2)20(26)9-17(13)25-14/h3-4,6-7,9,11,14-15,21,26H,5,8,10H2,1-2H3/t11?,14-,15+/m1/s1