4-ethyl-1-fluoranyl-3-[2-(3-fluoranylphenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium

Systemtic Name: 4-ethyl-1-fluoranyl-3-[2-(3-fluoranylphenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium Openeye Name: 4-ethyl-1-fluoro-3-[2-(3-fluorophenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium CAS Name: 4-ethyl-1-fluoro-3-[2-(3-fluorophenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium IUPAC Name: 4-ethyl-1-fluoro-3-[2-(3-fluorophenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium Traditional Name: 4-ethyl-1-fluoro-3-[2-(3-fluorophenoxy)phenyl]-3-methoxy-1-(3-phenylpropyl)piperazin-1-ium Formula: C28H33F2N2O2+ MolecularWeight: 467.570626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[N+](CC1(C2=CC=CC=C2OC3=CC(=CC=C3)F)OC)(CCCC4=CC=CC=C4)F

Isomeric SMILES

CCN1CC[N+](CC1(C2=CC=CC=C2OC3=CC(=CC=C3)F)OC)(CCCC4=CC=CC=C4)F

InChI

InChI=1S/C28H33F2N2O2/c1-3-31-18-20-32(30,19-10-13-23-11-5-4-6-12-23)22-28(31,33-2)26-16-7-8-17-27(26)34-25-15-9-14-24(29)21-25/h4-9,11-12,14-17,21H,3,10,13,18-20,22H2,1-2H3/q+1