2-butoxy-1-oxidanidyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,5-dihydropyrrol-1-ium

Systemtic Name: 2-butoxy-1-oxidanidyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,5-dihydropyrrol-1-ium Openeye Name: 2-butoxy-1-oxido-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,5-dihydropyrrol-1-ium CAS Name: 2-butoxy-1-oxido-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,5-dihydropyrrol-1-ium IUPAC Name: 2-butoxy-1-oxido-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,5-dihydropyrrol-1-ium Traditional Name: 2-butoxy-1-oxido-1-[3-(trifluoromethyl)phenyl]sulfonyl-3-pyrrolin-1-ium Formula: C15H18F3NO4S MolecularWeight: 365.36793

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18F3NO4S/c1-2-3-10-23-14-8-5-9-19(14,20)24(21,22)13-7-4-6-12(11-13)15(16,17)18/h4-8,11,14H,2-3,9-10H2,1H3