3-phenylpropyl-[[4-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: 3-phenylpropyl-[[4-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: 3-phenylpropyl-[[4-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: 3-phenylpropyl-[[4-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: 3-phenylpropyl-[[4-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: 3-phenylpropyl-[4-(trifluoromethyl)benzyl]ammonium Formula: C17H19F3N+ MolecularWeight: 294.33467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC[NH2+]CC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC[NH2+]CC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3N/c18-17(19,20)16-10-8-15(9-11-16)13-21-12-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-11,21H,4,7,12-13H2/p+1