5-hexyl-2-(phenylsulfonylamino)benzoic acid

Systemtic Name: 5-hexyl-2-(phenylsulfonylamino)benzoic acid Openeye Name: 2-(benzenesulfonamido)-5-hexyl-benzoic acid CAS Name: 2-(benzenesulfonamido)-5-hexylbenzoic acid IUPAC Name: 2-(benzenesulfonamido)-5-hexylbenzoic acid Traditional Name: 2-(benzenesulfonamido)-5-hexyl-benzoic acid Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H23NO4S/c1-2-3-4-6-9-15-12-13-18(17(14-15)19(21)22)20-25(23,24)16-10-7-5-8-11-16/h5,7-8,10-14,20H,2-4,6,9H2,1H3,(H,21,22)