N-[2-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[2-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[2-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-2-(1-naphthyl)acetamide CAS Name: N-[2-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[2-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-oxoethyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[2-[4-(2-chloro-6-fluoro-benzyl)piperazin-4-ium-1-yl]-2-keto-ethyl]-2-(1-naphthyl)acetamide Formula: C25H26ClFN3O2+ MolecularWeight: 454.944243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)F)C(=O)CNC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)F)C(=O)CNC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H25ClFN3O2/c26-22-9-4-10-23(27)21(22)17-29-11-13-30(14-12-29)25(32)16-28-24(31)15-19-7-3-6-18-5-1-2-8-20(18)19/h1-10H,11-17H2,(H,28,31)/p+1