3-chloranyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-(trifluoromethyl)pyridin-2-amine

Systemtic Name: 3-chloranyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-(trifluoromethyl)pyridin-2-amine Openeye Name: 3-chloro-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-5-(trifluoromethyl)pyridin-2-amine CAS Name: 3-chloro-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-5-(trifluoromethyl)-2-pyridinamine IUPAC Name: 3-chloro-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-5-(trifluoromethyl)pyridin-2-amine Traditional Name: [3-chloro-5-(trifluoromethyl)-2-pyridyl]-[(6-morpholinopyridin-1-ium-3-yl)methyl]amine Formula: C16H17ClF3N4O+ MolecularWeight: 373.78059

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C16H16ClF3N4O/c17-13-7-12(16(18,19)20)10-23-15(13)22-9-11-1-2-14(21-8-11)24-3-5-25-6-4-24/h1-2,7-8,10H,3-6,9H2,(H,22,23)/p+1