1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(phenylmethyl)sulfonyl-piperazine

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(phenylmethyl)sulfonyl-piperazine Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-benzylsulfonyl-piperazine CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-(phenylmethyl)sulfonylpiperazine IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-benzylsulfonylpiperazine Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-benzylsulfonyl-piperazine Formula: C23H32N3O2S+ MolecularWeight: 414.58408

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N3O2S/c27-29(28,20-22-9-5-2-6-10-22)26-17-15-25(16-18-26)23-11-13-24(14-12-23)19-21-7-3-1-4-8-21/h1-10,23H,11-20H2/p+1