5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-N-pyridin-1-ium-1-yl-benzamide chloride

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-N-pyridin-1-ium-1-yl-benzamide chloride Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-pyridin-1-ium-1-yl-benzamide chloride CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-(1-pyridin-1-iumyl)benzamide chloride IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-pyridin-1-ium-1-ylbenzamide chloride Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-N-pyridin-1-ium-1-yl-benzamide chloride Formula: C19H12Cl2F3N3O4 MolecularWeight: 474.21749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)NC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)NC(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C19H11ClF3N3O4.ClH/c20-15-10-12(19(21,22)23)4-7-17(15)30-13-5-6-16(26(28)29)14(11-13)18(27)24-25-8-2-1-3-9-25;/h1-11H;1H