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

Systemtic Name: [1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-piperidyl]-pyrrolidino-methanone Formula: C16H20ClF3N3O+ MolecularWeight: 362.79771

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C16H19ClF3N3O/c17-13-9-12(16(18,19)20)10-21-14(13)22-7-3-11(4-8-22)15(24)23-5-1-2-6-23/h9-11H,1-8H2/p+1