[1-[1-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-morpholin-4-yl-methanone

Systemtic Name: [1-[1-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-morpholin-4-yl-methanone Openeye Name: [1-[1-(5-chloro-2-fluoro-benzoyl)-4-piperidyl]piperidin-1-ium-4-yl]-morpholino-methanone CAS Name: [1-[1-[(5-chloro-2-fluorophenyl)-oxomethyl]-4-piperidinyl]-4-piperidin-1-iumyl]-(4-morpholinyl)methanone IUPAC Name: [1-[1-(5-chloro-2-fluorobenzoyl)piperidin-4-yl]piperidin-1-ium-4-yl]-morpholin-4-ylmethanone Traditional Name: [1-[1-(5-chloro-2-fluoro-benzoyl)-4-piperidyl]piperidin-1-ium-4-yl]-morpholino-methanone Formula: C22H30ClFN3O3+ MolecularWeight: 438.943303

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCOCC2)C3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCOCC2)C3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C22H29ClFN3O3/c23-17-1-2-20(24)19(15-17)22(29)26-9-5-18(6-10-26)25-7-3-16(4-8-25)21(28)27-11-13-30-14-12-27/h1-2,15-16,18H,3-14H2/p+1