(2S)-1-phenoxy-3-piperazine-1,4-diium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-phenoxy-3-piperazine-1,4-diium-1-yl-propan-2-ol Openeye Name: (2S)-1-phenoxy-3-piperazine-1,4-diium-1-yl-propan-2-ol CAS Name: (2S)-1-phenoxy-3-(1-piperazine-1,4-diiumyl)-2-propanol IUPAC Name: (2S)-1-phenoxy-3-piperazine-1,4-diium-1-ylpropan-2-ol Traditional Name: (2S)-1-phenoxy-3-piperazine-1,4-diium-1-yl-propan-2-ol Formula: C13H22N2O2+2 MolecularWeight: 238.32598

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC(COC2=CC=CC=C2)O

Isomeric SMILES

C1C[NH+](CC[NH2+]1)C[C@@H](COC2=CC=CC=C2)O

InChI

InChI=1S/C13H20N2O2/c16-12(10-15-8-6-14-7-9-15)11-17-13-4-2-1-3-5-13/h1-5,12,14,16H,6-11H2/p+2/t12-/m0/s1