4-methyl-2-tetradecyl-benzenesulfonic acid

Systemtic Name: 4-methyl-2-tetradecyl-benzenesulfonic acid Openeye Name: 4-methyl-2-tetradecyl-benzenesulfonic acid CAS Name: 4-methyl-2-tetradecylbenzenesulfonic acid IUPAC Name: 4-methyl-2-tetradecylbenzenesulfonic acid Traditional Name: 4-methyl-2-myristyl-besylic acid Formula: C21H36O3S MolecularWeight: 368.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(C=CC(=C1)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(C=CC(=C1)C)S(=O)(=O)O

InChI

InChI=1S/C21H36O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-18-19(2)16-17-21(20)25(22,23)24/h16-18H,3-15H2,1-2H3,(H,22,23,24)