[4-(4-fluoranylphenoxy)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [4-(4-fluoranylphenoxy)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [4-(4-fluorophenoxy)phenyl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [4-(4-fluorophenoxy)phenyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [4-(4-fluorophenoxy)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [4-(4-fluorophenoxy)phenyl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C22H22FN2O2S+ MolecularWeight: 397.485683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O2S/c23-18-5-9-20(10-6-18)27-19-7-3-17(4-8-19)22(26)25-13-11-24(12-14-25)16-21-2-1-15-28-21/h1-10,15H,11-14,16H2/p+1