1-[2-(4-chloranylphenoxy)ethyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[2-(4-chloranylphenoxy)ethyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[2-(4-chlorophenoxy)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-[2-(4-chlorophenoxy)ethyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-[2-(4-chlorophenoxy)ethyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-[2-(4-chlorophenoxy)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C16H20ClN2O3S2+ MolecularWeight: 387.9246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H19ClN2O3S2/c17-14-3-5-15(6-4-14)22-12-11-18-7-9-19(10-8-18)24(20,21)16-2-1-13-23-16/h1-6,13H,7-12H2/p+1