2-azanyl-5-chloranyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]-3-(trifluoromethyl)benzamide

Systemtic Name: 2-azanyl-5-chloranyl-N-[(1-ethylpyridin-1-ium-3-yl)methyl]-3-(trifluoromethyl)benzamide Openeye Name: 2-amino-5-chloro-N-[(1-ethylpyridin-1-ium-3-yl)methyl]-3-(trifluoromethyl)benzamide CAS Name: 2-amino-5-chloro-N-[(1-ethyl-3-pyridin-1-iumyl)methyl]-3-(trifluoromethyl)benzamide IUPAC Name: 2-amino-5-chloro-N-[(1-ethylpyridin-1-ium-3-yl)methyl]-3-(trifluoromethyl)benzamide Traditional Name: 2-amino-5-chloro-N-[(1-ethylpyridin-1-ium-3-yl)methyl]-3-(trifluoromethyl)benzamide Formula: C16H16ClF3N3O+ MolecularWeight: 358.76595

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)CNC(=O)C2=CC(=CC(=C2N)C(F)(F)F)Cl

Isomeric SMILES

CC[N+]1=CC=CC(=C1)CNC(=O)C2=CC(=CC(=C2N)C(F)(F)F)Cl

InChI

InChI=1S/C16H15ClF3N3O/c1-2-23-5-3-4-10(9-23)8-22-15(24)12-6-11(17)7-13(14(12)21)16(18,19)20/h3-7,9H,2,8H2,1H3,(H2-,21,22,24)/p+1