1-(4-chlorophenyl)sulfonyl-4-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]piperidin-4-ol

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]piperidin-4-ol Openeye Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-(4-chlorophenyl)sulfonyl-piperidin-4-ol CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-4-piperidinol IUPAC Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-(4-chlorophenyl)sulfonylpiperidin-4-ol Traditional Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-1-(4-chlorophenyl)sulfonyl-piperidin-4-ol Formula: C23H31ClN3O3S+ MolecularWeight: 465.02854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CN2CC[NH+](CC2)CC3=CC=CC=C3)O)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1(CN2CC[NH+](CC2)CC3=CC=CC=C3)O)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H30ClN3O3S/c24-21-6-8-22(9-7-21)31(29,30)27-12-10-23(28,11-13-27)19-26-16-14-25(15-17-26)18-20-4-2-1-3-5-20/h1-9,28H,10-19H2/p+1