1-[3-(4-fluoranylphenoxy)propyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-[3-(4-fluoranylphenoxy)propyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Formula: C20H26FN2O4S+ MolecularWeight: 409.494843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCCOC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN2O4S/c1-26-18-7-9-20(10-8-18)28(24,25)23-14-12-22(13-15-23)11-2-16-27-19-5-3-17(21)4-6-19/h3-10H,2,11-16H2,1H3/p+1