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

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-[2-methoxy-4-[(4-methyl-1-piperazin-4-iumyl)methyl]phenoxy]-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[2-methoxy-4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenoxy]propan-2-ol Formula: C22H40N4O3+2 MolecularWeight: 408.578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38N4O3/c1-4-24-11-13-26(14-12-24)17-20(27)18-29-21-6-5-19(15-22(21)28-3)16-25-9-7-23(2)8-10-25/h5-6,15,20,27H,4,7-14,16-18H2,1-3H3/p+2/t20-/m0/s1