[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-thiophen-3-yl-methanone

Systemtic Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-thiophen-3-yl-methanone Openeye Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(3-thienyl)methanone CAS Name: [4-[bis(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-(3-thiophenyl)methanone IUPAC Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-thiophen-3-ylmethanone Traditional Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(3-thienyl)methanone Formula: C22H21F2N2OS+ MolecularWeight: 399.476746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20F2N2OS/c23-19-5-1-16(2-6-19)21(17-3-7-20(24)8-4-17)25-10-12-26(13-11-25)22(27)18-9-14-28-15-18/h1-9,14-15,21H,10-13H2/p+1