[(2R)-2-methylbutyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-2-methylbutyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-2-methylbutyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-2-methylbutyl] ester IUPAC Name: [(2R)-2-methylbutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-2-methylbutyl] ester Formula: C12H18O3S MolecularWeight: 242.33452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CC[C@@H](C)COS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C12H18O3S/c1-4-10(2)9-15-16(13,14)12-7-5-11(3)6-8-12/h5-8,10H,4,9H2,1-3H3/t10-/m1/s1