2-hexylsulfonylbenzoic acid

Systemtic Name: 2-hexylsulfonylbenzoic acid Openeye Name: 2-hexylsulfonylbenzoic acid CAS Name: 2-hexylsulfonylbenzoic acid IUPAC Name: 2-hexylsulfonylbenzoic acid Traditional Name: 2-hexylsulfonylbenzoic acid Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCS(=O)(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H18O4S/c1-2-3-4-7-10-18(16,17)12-9-6-5-8-11(12)13(14)15/h5-6,8-9H,2-4,7,10H2,1H3,(H,14,15)