[(2S)-4-(2-methylphenoxy)-2-oxidanyl-butyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-4-(2-methylphenoxy)-2-oxidanyl-butyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-2-hydroxy-4-(2-methylphenoxy)butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-2-hydroxy-4-(2-methylphenoxy)butyl] ester IUPAC Name: [(2S)-2-hydroxy-4-(2-methylphenoxy)butyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-2-hydroxy-4-(2-methylphenoxy)butyl] ester Formula: C18H22O5S MolecularWeight: 350.42928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCOC2=CC=CC=C2C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](CCOC2=CC=CC=C2C)O

InChI

InChI=1S/C18H22O5S/c1-14-7-9-17(10-8-14)24(20,21)23-13-16(19)11-12-22-18-6-4-3-5-15(18)2/h3-10,16,19H,11-13H2,1-2H3/t16-/m0/s1