(5-methyl-2-propyl-phenyl) benzenesulfonate

Systemtic Name: (5-methyl-2-propyl-phenyl) benzenesulfonate Openeye Name: (5-methyl-2-propyl-phenyl) benzenesulfonate CAS Name: benzenesulfonic acid (5-methyl-2-propylphenyl) ester IUPAC Name: (5-methyl-2-propylphenyl) benzenesulfonate Traditional Name: benzenesulfonic acid (5-methyl-2-propyl-phenyl) ester Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C)OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC1=C(C=C(C=C1)C)OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18O3S/c1-3-7-14-11-10-13(2)12-16(14)19-20(17,18)15-8-5-4-6-9-15/h4-6,8-12H,3,7H2,1-2H3