2-methyl-1-[3,3,3-tris(fluoranyl)propyl]quinolin-1-ium perchlorate

Systemtic Name: 2-methyl-1-[3,3,3-tris(fluoranyl)propyl]quinolin-1-ium perchlorate Openeye Name: 2-methyl-1-(3,3,3-trifluoropropyl)quinolin-1-ium perchlorate CAS Name: 2-methyl-1-(3,3,3-trifluoropropyl)quinolin-1-ium perchlorate IUPAC Name: 2-methyl-1-(3,3,3-trifluoropropyl)quinolin-1-ium perchlorate Traditional Name: 2-methyl-1-(3,3,3-trifluoropropyl)quinolin-1-ium perchlorate Formula: C13H13ClF3NO4 MolecularWeight: 339.69483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2C=C1)CCC(F)(F)F.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2C=C1)CCC(F)(F)F.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H13F3N.ClHO4/c1-10-6-7-11-4-2-3-5-12(11)17(10)9-8-13(14,15)16;2-1(3,4)5/h2-7H,8-9H2,1H3;(H,2,3,4,5)/q+1;/p-1