(1-cyclohexyl-2-methyl-pentyl) 4-methylbenzenesulfonate

Systemtic Name: (1-cyclohexyl-2-methyl-pentyl) 4-methylbenzenesulfonate Openeye Name: (1-cyclohexyl-2-methyl-pentyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-cyclohexyl-2-methylpentyl) ester IUPAC Name: (1-cyclohexyl-2-methylpentyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-cyclohexyl-2-methyl-pentyl) ester Formula: C19H30O3S MolecularWeight: 338.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(C1CCCCC1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(C)C(C1CCCCC1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H30O3S/c1-4-8-16(3)19(17-9-6-5-7-10-17)22-23(20,21)18-13-11-15(2)12-14-18/h11-14,16-17,19H,4-10H2,1-3H3