[4-(2-methylpropyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(2-methylpropyl)phenyl] 4-methylbenzenesulfonate Openeye Name: (4-isobutylphenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(2-methylpropyl)phenyl] ester IUPAC Name: [4-(2-methylpropyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-isobutylphenyl) ester Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C17H20O3S/c1-13(2)12-15-6-8-16(9-7-15)20-21(18,19)17-10-4-14(3)5-11-17/h4-11,13H,12H2,1-3H3