4-(pentylsulfonylamino)benzoic acid

Systemtic Name: 4-(pentylsulfonylamino)benzoic acid Openeye Name: 4-(pentylsulfonylamino)benzoic acid CAS Name: 4-(pentylsulfonylamino)benzoic acid IUPAC Name: 4-(pentylsulfonylamino)benzoic acid Traditional Name: 4-(amylsulfonylamino)benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCS(=O)(=O)NC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H17NO4S/c1-2-3-4-9-18(16,17)13-11-7-5-10(6-8-11)12(14)15/h5-8,13H,2-4,9H2,1H3,(H,14,15)