1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[1-(4-chlorophenyl)sulfonyl-4-piperidyl]-4-phenyl-piperazin-1-ium Formula: C21H27ClN3O2S+ MolecularWeight: 420.97598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H26ClN3O2S/c22-18-6-8-21(9-7-18)28(26,27)25-12-10-20(11-13-25)24-16-14-23(15-17-24)19-4-2-1-3-5-19/h1-9,20H,10-17H2/p+1