[(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-yl] 4-methylbenzenesulfonate Openeye Name: [(1S,2S)-2-(2,5-dimethoxyphenyl)-1-methyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-yl] ester IUPAC Name: [(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-(2,5-dimethoxyphenyl)-1-methyl-propyl] 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)C(C)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H24O5S/c1-13-6-9-17(10-7-13)25(20,21)24-15(3)14(2)18-12-16(22-4)8-11-19(18)23-5/h6-12,14-15H,1-5H3/t14-,15+/m1/s1