5-chloranyl-N-[4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-benzamide

Systemtic Name: 5-chloranyl-N-[4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-benzamide Openeye Name: 5-chloro-N-[4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-benzamide CAS Name: 5-chloro-N-[4-[4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]phenyl]-2-methoxybenzamide IUPAC Name: 5-chloro-N-[4-[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxybenzamide Traditional Name: 5-chloro-N-[4-[4-(4-fluorobenzyl)piperazin-4-ium-1-yl]phenyl]-2-methoxy-benzamide Formula: C25H26ClFN3O2+ MolecularWeight: 454.944243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H25ClFN3O2/c1-32-24-11-4-19(26)16-23(24)25(31)28-21-7-9-22(10-8-21)30-14-12-29(13-15-30)17-18-2-5-20(27)6-3-18/h2-11,16H,12-15,17H2,1H3,(H,28,31)/p+1