(2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)piperazin-4-ium-1-yl]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)piperazin-4-ium-1-yl]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)piperazin-4-ium-1-yl]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)-1-piperazin-4-iumyl]methyl]phenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)piperazin-4-ium-1-yl]methyl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[2-methoxy-5-[[4-(2-methoxyethyl)piperazin-4-ium-1-yl]methyl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C23H41N3O4+2 MolecularWeight: 423.58934

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OC)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

COCC[NH+]1CCN(CC1)CC2=CC(=C(C=C2)OC)OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C23H39N3O4/c1-28-15-14-24-10-12-26(13-11-24)17-20-6-7-22(29-2)23(16-20)30-19-21(27)18-25-8-4-3-5-9-25/h6-7,16,21,27H,3-5,8-15,17-19H2,1-2H3/p+2/t21-/m1/s1