2-butoxy-1-oxidanidyl-1-(phenylsulfonyl)-2,5-dihydropyrrol-1-ium

Systemtic Name: 2-butoxy-1-oxidanidyl-1-(phenylsulfonyl)-2,5-dihydropyrrol-1-ium Openeye Name: 1-(benzenesulfonyl)-2-butoxy-1-oxido-2,5-dihydropyrrol-1-ium CAS Name: 1-(benzenesulfonyl)-2-butoxy-1-oxido-2,5-dihydropyrrol-1-ium IUPAC Name: 1-(benzenesulfonyl)-2-butoxy-1-oxido-2,5-dihydropyrrol-1-ium Traditional Name: 1-besyl-2-butoxy-1-oxido-3-pyrrolin-1-ium Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C=CC[N+]1([O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCOC1C=CC[N+]1([O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H19NO4S/c1-2-3-12-19-14-10-7-11-15(14,16)20(17,18)13-8-5-4-6-9-13/h4-10,14H,2-3,11-12H2,1H3