(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[3-(1,2-oxazinan-2-ylmethyl)phenoxy]propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[3-(1,2-oxazinan-2-ylmethyl)phenoxy]propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[3-(oxazinan-2-ylmethyl)phenoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-[3-(2-oxazinanylmethyl)phenoxy]-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[3-(oxazinan-2-ylmethyl)phenoxy]propan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[3-(oxazinan-2-ylmethyl)phenoxy]propan-2-ol Formula: C20H34N3O3+ MolecularWeight: 364.50226

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2=CC=CC(=C2)CN3CCCCO3)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC2=CC=CC(=C2)CN3CCCCO3)O

InChI

InChI=1S/C20H33N3O3/c1-2-21-9-11-22(12-10-21)16-19(24)17-25-20-7-5-6-18(14-20)15-23-8-3-4-13-26-23/h5-7,14,19,24H,2-4,8-13,15-17H2,1H3/p+1/t19-/m0/s1