1-(5-chloranylthiophen-2-yl)sulfonyl-4-[2-(4-fluoranylphenoxy)ethyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-4-[2-(4-fluoranylphenoxy)ethyl]piperazin-4-ium Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-[2-(4-fluorophenoxy)ethyl]piperazin-4-ium CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-4-[2-(4-fluorophenoxy)ethyl]piperazin-4-ium IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-4-[2-(4-fluorophenoxy)ethyl]piperazin-4-ium Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-[2-(4-fluorophenoxy)ethyl]piperazin-4-ium Formula: C16H19ClFN2O3S2+ MolecularWeight: 405.915063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H18ClFN2O3S2/c17-15-5-6-16(24-15)25(21,22)20-9-7-19(8-10-20)11-12-23-14-3-1-13(18)2-4-14/h1-6H,7-12H2/p+1