[(2S)-1-(2,5-dimethoxy-4-methyl-phenyl)propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-1-(2,5-dimethoxy-4-methyl-phenyl)propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [(1S)-2-(2,5-dimethoxy-4-methyl-phenyl)-1-methyl-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-1-(2,5-dimethoxy-4-methylphenyl)propan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethoxy-4-methylphenyl)propan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S)-2-(2,5-dimethoxy-4-methyl-phenyl)-1-methyl-ethyl] ester Formula: C19H24O5S MolecularWeight: 364.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)CC2=C(C=C(C(=C2)OC)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](C)CC2=C(C=C(C(=C2)OC)C)OC

InChI

InChI=1S/C19H24O5S/c1-13-6-8-17(9-7-13)25(20,21)24-15(3)11-16-12-18(22-4)14(2)10-19(16)23-5/h6-10,12,15H,11H2,1-5H3/t15-/m0/s1