N-[(2R)-4-phenylbutan-2-yl]-5-(trifluoromethyl)pyridin-1-ium-2-amine

Systemtic Name: N-[(2R)-4-phenylbutan-2-yl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine CAS Name: N-[(2R)-4-phenylbutan-2-yl]-5-(trifluoromethyl)-2-pyridin-1-iumamine IUPAC Name: N-[(2R)-4-phenylbutan-2-yl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Traditional Name: [(1R)-1-methyl-3-phenyl-propyl]-[5-(trifluoromethyl)pyridin-1-ium-2-yl]amine Formula: C16H18F3N2+ MolecularWeight: 295.32273

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC2=[NH+]C=C(C=C2)C(F)(F)F

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC2=[NH+]C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H17F3N2/c1-12(7-8-13-5-3-2-4-6-13)21-15-10-9-14(11-20-15)16(17,18)19/h2-6,9-12H,7-8H2,1H3,(H,20,21)/p+1/t12-/m1/s1