[(2S,4R)-1-(2,4-dimethoxy-3-methyl-phenyl)-1,1-dimethoxy-4-methyl-hex-5-yn-2-yl] methanesulfonate

Systemtic Name: [(2S,4R)-1-(2,4-dimethoxy-3-methyl-phenyl)-1,1-dimethoxy-4-methyl-hex-5-yn-2-yl] methanesulfonate Openeye Name: [(1S,3R)-1-[(2,4-dimethoxy-3-methyl-phenyl)-dimethoxy-methyl]-3-methyl-pent-4-ynyl] methanesulfonate CAS Name: methanesulfonic acid [(2S,4R)-1-(2,4-dimethoxy-3-methylphenyl)-1,1-dimethoxy-4-methylhex-5-yn-2-yl] ester IUPAC Name: [(2S,4R)-1-(2,4-dimethoxy-3-methylphenyl)-1,1-dimethoxy-4-methylhex-5-yn-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S,3R)-1-[(2,4-dimethoxy-3-methyl-phenyl)-dimethoxy-methyl]-3-methyl-pent-4-ynyl] ester Formula: C19H28O7S MolecularWeight: 400.48642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)C(C(CC(C)C#C)OS(=O)(=O)C)(OC)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)C([C@H](C[C@@H](C)C#C)OS(=O)(=O)C)(OC)OC)OC

InChI

InChI=1S/C19H28O7S/c1-9-13(2)12-17(26-27(8,20)21)19(24-6,25-7)15-10-11-16(22-4)14(3)18(15)23-5/h1,10-11,13,17H,12H2,2-8H3/t13-,17-/m0/s1