4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]benzenesulfonic acid

Systemtic Name: 4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]benzenesulfonic acid Openeye Name: 4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]benzenesulfonic acid CAS Name: 4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]benzenesulfonic acid IUPAC Name: 4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]benzenesulfonic acid Traditional Name: 4-[4-[2-(propylsulfonylamino)cyclopentyl]phenyl]besylic acid Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1CCCC1C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CCCS(=O)(=O)NC1CCCC1C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C20H25NO5S2/c1-2-14-27(22,23)21-20-5-3-4-19(20)17-8-6-15(7-9-17)16-10-12-18(13-11-16)28(24,25)26/h6-13,19-21H,2-5,14H2,1H3,(H,24,25,26)