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

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-propan-2-ylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-isopropylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-[2-methoxy-4-[(4-propan-2-yl-1-piperazin-4-iumyl)methyl]phenoxy]-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-propan-2-ylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[4-[(4-isopropylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C24H44N4O3+2 MolecularWeight: 436.63116

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2=C(C=C(C=C2)CN3CC[NH+](CC3)C(C)C)OC)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC2=C(C=C(C=C2)CN3CC[NH+](CC3)C(C)C)OC)O

InChI

InChI=1S/C24H42N4O3/c1-5-25-8-10-27(11-9-25)18-22(29)19-31-23-7-6-21(16-24(23)30-4)17-26-12-14-28(15-13-26)20(2)3/h6-7,16,20,22,29H,5,8-15,17-19H2,1-4H3/p+2/t22-/m0/s1