[1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-yl]-morpholin-4-yl-methanone

Systemtic Name: [1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-yl]-morpholin-4-yl-methanone Openeye Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidyl]-morpholino-methanone CAS Name: [1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinyl]-(4-morpholinyl)methanone IUPAC Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-yl]-morpholin-4-ylmethanone Traditional Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidyl]-morpholino-methanone Formula: C16H20ClF3N3O2+ MolecularWeight: 378.79711

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCOCC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N2CCOCC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C16H19ClF3N3O2/c17-13-9-12(16(18,19)20)10-21-14(13)22-3-1-11(2-4-22)15(24)23-5-7-25-8-6-23/h9-11H,1-8H2/p+1