1-phenyl-4-[1-(phenylsulfonyl)piperidin-4-yl]piperazin-4-ium

Systemtic Name: 1-phenyl-4-[1-(phenylsulfonyl)piperidin-4-yl]piperazin-4-ium Openeye Name: 1-[1-(benzenesulfonyl)-4-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[1-(benzenesulfonyl)-4-piperidinyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[1-(benzenesulfonyl)piperidin-4-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-(1-besyl-4-piperidyl)-4-phenyl-piperazin-1-ium Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2S/c25-27(26,21-9-5-2-6-10-21)24-13-11-20(12-14-24)23-17-15-22(16-18-23)19-7-3-1-4-8-19/h1-10,20H,11-18H2/p+1