(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-[4-[(4-ethyl-1-piperazin-4-iumyl)methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C23H42N4O3+2 MolecularWeight: 422.60458

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OCC(CN3CC[NH+](CC3)CC)O)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OC[C@H](CN3CC[NH+](CC3)CC)O)OC

InChI

InChI=1S/C23H40N4O3/c1-4-24-8-12-26(13-9-24)17-20-6-7-22(23(16-20)29-3)30-19-21(28)18-27-14-10-25(5-2)11-15-27/h6-7,16,21,28H,4-5,8-15,17-19H2,1-3H3/p+2/t21-/m0/s1