3-chloranyl-N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]benzamide Openeye Name: 3-chloro-N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]benzamide CAS Name: 3-chloro-N-[(2S)-2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 3-chloro-N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-ylethyl]benzamide Traditional Name: 3-chloro-N-[(2S)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]benzamide Formula: C24H25ClFN4O+ MolecularWeight: 439.932903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(CNC(=O)C2=CC(=CC=C2)Cl)C3=CN=CC=C3)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1[C@H](CNC(=O)C2=CC(=CC=C2)Cl)C3=CN=CC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C24H24ClFN4O/c25-20-7-3-5-18(15-20)24(31)28-17-23(19-6-4-10-27-16-19)30-13-11-29(12-14-30)22-9-2-1-8-21(22)26/h1-10,15-16,23H,11-14,17H2,(H,28,31)/p+1/t23-/m1/s1