2-[4-[3-(methylsulfonylamino)propyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[3-(methylsulfonylamino)propyl]phenyl]ethanoic acid Openeye Name: 2-[4-[3-(methanesulfonamido)propyl]phenyl]acetic acid CAS Name: 2-[4-[3-(methanesulfonamido)propyl]phenyl]acetic acid IUPAC Name: 2-[4-[3-(methanesulfonamido)propyl]phenyl]acetic acid Traditional Name: 2-[4-[3-(methanesulfonamido)propyl]phenyl]acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CS(=O)(=O)NCCCC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-18(16,17)13-8-2-3-10-4-6-11(7-5-10)9-12(14)15/h4-7,13H,2-3,8-9H2,1H3,(H,14,15)