2-heptyl-6-phenyl-benzenesulfonic acid

Systemtic Name: 2-heptyl-6-phenyl-benzenesulfonic acid Openeye Name: 2-heptyl-6-phenyl-benzenesulfonic acid CAS Name: 2-heptyl-6-phenylbenzenesulfonic acid IUPAC Name: 2-heptyl-6-phenylbenzenesulfonic acid Traditional Name: 2-heptyl-6-phenyl-besylic acid Formula: C19H24O3S MolecularWeight: 332.45706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=CC(=C1S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1=CC=CC(=C1S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C19H24O3S/c1-2-3-4-5-7-13-17-14-10-15-18(19(17)23(20,21)22)16-11-8-6-9-12-16/h6,8-12,14-15H,2-5,7,13H2,1H3,(H,20,21,22)