(2S)-1-naphthalen-2-yloxy-3-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-naphthalen-2-yloxy-3-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(2-naphthyloxy)-3-[4-(1-piperidylsulfonyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-(2-naphthalenyloxy)-3-[4-(1-piperidinylsulfonyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-naphthalen-2-yloxy-3-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(2-naphthoxy)-3-(4-piperidinosulfonylpiperazin-1-ium-1-yl)propan-2-ol Formula: C22H32N3O4S+ MolecularWeight: 434.57218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)N2CC[NH+](CC2)CC(COC3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)N2CC[NH+](CC2)C[C@@H](COC3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C22H31N3O4S/c26-21(18-29-22-9-8-19-6-2-3-7-20(19)16-22)17-23-12-14-25(15-13-23)30(27,28)24-10-4-1-5-11-24/h2-3,6-9,16,21,26H,1,4-5,10-15,17-18H2/p+1/t21-/m0/s1