1-(4-chlorophenyl)sulfonyl-4-(2-pyridin-4-ylethyl)piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-(2-pyridin-4-ylethyl)piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(4-pyridyl)ethyl]piperazin-4-ium CAS Name: 1-(4-chlorophenyl)sulfonyl-4-(2-pyridin-4-ylethyl)piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-(2-pyridin-4-ylethyl)piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(4-pyridyl)ethyl]piperazin-4-ium Formula: C17H21ClN3O2S+ MolecularWeight: 366.88554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H20ClN3O2S/c18-16-1-3-17(4-2-16)24(22,23)21-13-11-20(12-14-21)10-7-15-5-8-19-9-6-15/h1-6,8-9H,7,10-14H2/p+1