[(2S,4S)-4-[(4-methoxyphenyl)methoxy]pentan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,4S)-4-[(4-methoxyphenyl)methoxy]pentan-2-yl] 4-methylbenzenesulfonate Openeye Name: [(1S,3S)-3-[(4-methoxyphenyl)methoxy]-1-methyl-butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,4S)-4-[(4-methoxyphenyl)methoxy]pentan-2-yl] ester IUPAC Name: [(2S,4S)-4-[(4-methoxyphenyl)methoxy]pentan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,3S)-1-methyl-3-p-anisyloxy-butyl] ester Formula: C20H26O5S MolecularWeight: 378.48244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)CC(C)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](C)C[C@H](C)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H26O5S/c1-15-5-11-20(12-6-15)26(21,22)25-17(3)13-16(2)24-14-18-7-9-19(23-4)10-8-18/h5-12,16-17H,13-14H2,1-4H3/t16-,17-/m0/s1