N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-5-[3-(trifluoromethyl)phenyl]-2-furancarboxamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-5-[3-(trifluoromethyl)phenyl]-2-furamide Formula: C24H25F3N3O2+ MolecularWeight: 444.46941

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C24H24F3N3O2/c25-24(26,27)19-6-4-5-18(17-19)21-9-10-22(32-21)23(31)28-11-12-29-13-15-30(16-14-29)20-7-2-1-3-8-20/h1-10,17H,11-16H2,(H,28,31)/p+1