3-decyl-4-methyl-benzenesulfonic acid

Systemtic Name: 3-decyl-4-methyl-benzenesulfonic acid Openeye Name: 3-decyl-4-methyl-benzenesulfonic acid CAS Name: 3-decyl-4-methylbenzenesulfonic acid IUPAC Name: 3-decyl-4-methylbenzenesulfonic acid Traditional Name: 3-decyl-4-methyl-besylic acid Formula: C17H28O3S MolecularWeight: 312.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C=CC(=C1)S(=O)(=O)O)C

Isomeric SMILES

CCCCCCCCCCC1=C(C=CC(=C1)S(=O)(=O)O)C

InChI

InChI=1S/C17H28O3S/c1-3-4-5-6-7-8-9-10-11-16-14-17(21(18,19)20)13-12-15(16)2/h12-14H,3-11H2,1-2H3,(H,18,19,20)