[(1R,4S,4aR,9bS)-7,9-dimethoxy-4-oxidanyl-1-propan-2-yl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(1R,4S,4aR,9bS)-7,9-dimethoxy-4-oxidanyl-1-propan-2-yl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(1R,4S,4aR,9bS)-4-hydroxy-1-isopropyl-7,9-dimethoxy-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1R,4S,4aR,9bS)-4-hydroxy-7,9-dimethoxy-1-propan-2-yl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl ester IUPAC Name: [(1R,4S,4aR,9bS)-4-hydroxy-7,9-dimethoxy-1-propan-2-yl-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R,4S,4aR,9bS)-4-hydroxy-1-isopropyl-7,9-dimethoxy-2,3,4a,9b-tetrahydro-1H-dibenzofuran-4-yl]methyl ester Formula: C25H32O7S MolecularWeight: 476.58238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2(CCC(C3C2OC4=CC(=CC(=C34)OC)OC)C(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@]2(CC[C@@H]([C@@H]3[C@H]2OC4=CC(=CC(=C34)OC)OC)C(C)C)O

InChI

InChI=1S/C25H32O7S/c1-15(2)19-10-11-25(26,14-31-33(27,28)18-8-6-16(3)7-9-18)24-22(19)23-20(30-5)12-17(29-4)13-21(23)32-24/h6-9,12-13,15,19,22,24,26H,10-11,14H2,1-5H3/t19-,22+,24-,25+/m1/s1