3-(3-nitrophenoxy)propane-1-sulfonic acid

Systemtic Name: 3-(3-nitrophenoxy)propane-1-sulfonic acid Openeye Name: 3-(3-nitrophenoxy)propane-1-sulfonic acid CAS Name: 3-(3-nitrophenoxy)-1-propanesulfonic acid IUPAC Name: 3-(3-nitrophenoxy)propane-1-sulfonic acid Traditional Name: 3-(3-nitrophenoxy)propane-1-sulfonic acid Formula: C9H11NO6S MolecularWeight: 261.25174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCS(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCCCS(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H11NO6S/c11-10(12)8-3-1-4-9(7-8)16-5-2-6-17(13,14)15/h1,3-4,7H,2,5-6H2,(H,13,14,15)