2-(phenylsulfonyl)-5-propoxy-2,5-dihydropyrrol-1-ium 1-oxide

Systemtic Name: 2-(phenylsulfonyl)-5-propoxy-2,5-dihydropyrrol-1-ium 1-oxide Openeye Name: 2-(benzenesulfonyl)-5-propoxy-2,5-dihydropyrrol-1-ium 1-oxide CAS Name: 2-(benzenesulfonyl)-5-propoxy-2,5-dihydropyrrol-1-ium 1-oxide IUPAC Name: 2-(benzenesulfonyl)-5-propoxy-2,5-dihydropyrrol-1-ium 1-oxide Traditional Name: 2-besyl-5-propoxy-3-pyrrolin-1-ium 1-oxide Formula: C13H16NO4S+ MolecularWeight: 282.33544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C=CC([N+]1=O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCOC1C=CC([N+]1=O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16NO4S/c1-2-10-18-12-8-9-13(14(12)15)19(16,17)11-6-4-3-5-7-11/h3-9,12-13H,2,10H2,1H3/q+1