(2R)-1-[5-methoxy-2-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-[5-methoxy-2-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-[5-methoxy-2-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-[5-methoxy-2-[[2-(1-pyrrolidin-1-iumyl)ethylamino]methyl]phenoxy]-3-(4-methyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-[5-methoxy-2-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-[5-methoxy-2-[(2-pyrrolidin-1-ium-1-ylethylamino)methyl]phenoxy]-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Formula: C22H40N4O3+2 MolecularWeight: 408.578

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(COC2=C(C=CC(=C2)OC)CNCC[NH+]3CCCC3)O

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@H](COC2=C(C=CC(=C2)OC)CNCC[NH+]3CCCC3)O

InChI

InChI=1S/C22H38N4O3/c1-24-11-13-26(14-12-24)17-20(27)18-29-22-15-21(28-2)6-5-19(22)16-23-7-10-25-8-3-4-9-25/h5-6,15,20,23,27H,3-4,7-14,16-18H2,1-2H3/p+2/t20-/m1/s1