(2S)-1-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: (2S)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-isopropoxy-propan-2-ol CAS Name: (2S)-1-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: (2S)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-propan-2-yloxypropan-2-ol Traditional Name: (2S)-1-(4-benzylpiperazine-1,4-diium-1-yl)-3-isopropoxy-propan-2-ol Formula: C17H30N2O2+2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)OC[C@H](C[NH+]1CC[NH+](CC1)CC2=CC=CC=C2)O

InChI

InChI=1S/C17H28N2O2/c1-15(2)21-14-17(20)13-19-10-8-18(9-11-19)12-16-6-4-3-5-7-16/h3-7,15,17,20H,8-14H2,1-2H3/p+2/t17-/m0/s1