N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carboxamide Openeye Name: N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carboxamide CAS Name: N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinecarboxamide IUPAC Name: N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carboxamide Traditional Name: N-(3,4-dichlorophenyl)-4-[3-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carboxamide Formula: C17H16Cl2F3N4O+ MolecularWeight: 420.23635

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H15Cl2F3N4O/c18-13-4-3-11(10-14(13)19)24-16(27)26-8-6-25(7-9-26)15-12(17(20,21)22)2-1-5-23-15/h1-5,10H,6-9H2,(H,24,27)/p+1