(3R)-4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-2-one

Systemtic Name: (3R)-4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-2-one Openeye Name: (3R)-4-[(2-chloro-6-fluoro-phenyl)methyl]-3-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-[(2-chloro-6-fluorophenyl)methyl]-3-[2-oxo-2-(1-piperidinyl)ethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-[(2-chloro-6-fluorophenyl)methyl]-3-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-2-one Traditional Name: (3R)-4-(2-chloro-6-fluoro-benzyl)-3-(2-keto-2-piperidino-ethyl)piperazin-4-ium-2-one Formula: C18H24ClFN3O2+ MolecularWeight: 368.853463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CC2C(=O)NCC[NH+]2CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(CC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H23ClFN3O2/c19-14-5-4-6-15(20)13(14)12-23-10-7-21-18(25)16(23)11-17(24)22-8-2-1-3-9-22/h4-6,16H,1-3,7-12H2,(H,21,25)/p+1/t16-/m1/s1