4-(2,4,6-trimethylheptan-4-yl)benzenesulfonic acid

Systemtic Name: 4-(2,4,6-trimethylheptan-4-yl)benzenesulfonic acid Openeye Name: 4-(1-isobutyl-1,3-dimethyl-butyl)benzenesulfonic acid CAS Name: 4-(2,4,6-trimethylheptan-4-yl)benzenesulfonic acid IUPAC Name: 4-(2,4,6-trimethylheptan-4-yl)benzenesulfonic acid Traditional Name: 4-(1-isobutyl-1,3-dimethyl-butyl)besylic acid Formula: C16H26O3S MolecularWeight: 298.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(CC(C)C)C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC(C)CC(C)(CC(C)C)C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C16H26O3S/c1-12(2)10-16(5,11-13(3)4)14-6-8-15(9-7-14)20(17,18)19/h6-9,12-13H,10-11H2,1-5H3,(H,17,18,19)