1-(2-hexylphenyl)-2,2-dimethyl-propane-1-sulfonic acid

Systemtic Name: 1-(2-hexylphenyl)-2,2-dimethyl-propane-1-sulfonic acid Openeye Name: 1-(2-hexylphenyl)-2,2-dimethyl-propane-1-sulfonic acid CAS Name: 1-(2-hexylphenyl)-2,2-dimethyl-1-propanesulfonic acid IUPAC Name: 1-(2-hexylphenyl)-2,2-dimethylpropane-1-sulfonic acid Traditional Name: 1-(2-hexylphenyl)-2,2-dimethyl-propane-1-sulfonic acid Formula: C17H28O3S MolecularWeight: 312.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1C(C(C)(C)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCC1=CC=CC=C1C(C(C)(C)C)S(=O)(=O)O

InChI

InChI=1S/C17H28O3S/c1-5-6-7-8-11-14-12-9-10-13-15(14)16(17(2,3)4)21(18,19)20/h9-10,12-13,16H,5-8,11H2,1-4H3,(H,18,19,20)