3-(4-fluorophenyl)propane-1-sulfonic acid

Systemtic Name: 3-(4-fluorophenyl)propane-1-sulfonic acid Openeye Name: 3-(4-fluorophenyl)propane-1-sulfonic acid CAS Name: 3-(4-fluorophenyl)-1-propanesulfonic acid IUPAC Name: 3-(4-fluorophenyl)propane-1-sulfonic acid Traditional Name: 3-(4-fluorophenyl)propane-1-sulfonic acid Formula: C9H11FO3S MolecularWeight: 218.245243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCS(=O)(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1CCCS(=O)(=O)O)F

InChI

InChI=1S/C9H11FO3S/c10-9-5-3-8(4-6-9)2-1-7-14(11,12)13/h3-6H,1-2,7H2,(H,11,12,13)