3-butyl-1-ethyl-4-iodanyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium

Systemtic Name: 3-butyl-1-ethyl-4-iodanyl-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Openeye Name: 3-butyl-1-ethyl-4-iodo-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium CAS Name: 3-butyl-1-ethyl-4-iodo-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium IUPAC Name: 3-butyl-1-ethyl-4-iodo-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Traditional Name: 3-butyl-1-ethyl-4-iodo-5-[3-(trifluoromethyl)phenyl]pyridin-1-ium Formula: C18H20F3IN+ MolecularWeight: 434.25778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C[N+](=C1)CC)C2=CC(=CC=C2)C(F)(F)F)I

Isomeric SMILES

CCCCC1=C(C(=C[N+](=C1)CC)C2=CC(=CC=C2)C(F)(F)F)I

InChI

InChI=1S/C18H20F3IN/c1-3-5-7-14-11-23(4-2)12-16(17(14)22)13-8-6-9-15(10-13)18(19,20)21/h6,8-12H,3-5,7H2,1-2H3/q+1