N-[(2-methyl-1H-indol-3-yl)-pyridin-1-ium-3-yl-methyl]-3-(trifluoromethyl)aniline

Systemtic Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-1-ium-3-yl-methyl]-3-(trifluoromethyl)aniline Openeye Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-1-ium-3-yl-methyl]-3-(trifluoromethyl)aniline CAS Name: N-[(2-methyl-1H-indol-3-yl)-(3-pyridin-1-iumyl)methyl]-3-(trifluoromethyl)aniline IUPAC Name: N-[(2-methyl-1H-indol-3-yl)-pyridin-1-ium-3-ylmethyl]-3-(trifluoromethyl)aniline Traditional Name: [(2-methyl-1H-indol-3-yl)-pyridin-1-ium-3-yl-methyl]-[3-(trifluoromethyl)phenyl]amine Formula: C22H19F3N3+ MolecularWeight: 382.40157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=C[NH+]=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(C3=C[NH+]=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3N3/c1-14-20(18-9-2-3-10-19(18)27-14)21(15-6-5-11-26-13-15)28-17-8-4-7-16(12-17)22(23,24)25/h2-13,21,27-28H,1H3/p+1