[(2R)-2-methyl-3-phenylmethoxy-propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-2-methyl-3-phenylmethoxy-propyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-3-benzyloxy-2-methyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-2-methyl-3-phenylmethoxypropyl] ester IUPAC Name: [(2R)-2-methyl-3-phenylmethoxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-3-benzoxy-2-methyl-propyl] ester Formula: C18H22O4S MolecularWeight: 334.42988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)COCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C)COCC2=CC=CC=C2

InChI

InChI=1S/C18H22O4S/c1-15-8-10-18(11-9-15)23(19,20)22-13-16(2)12-21-14-17-6-4-3-5-7-17/h3-11,16H,12-14H2,1-2H3/t16-/m1/s1