[4-methoxy-2-[(2R)-3-(4-methylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-(2-pyridin-3-yloxyethyl)azanium

Systemtic Name: [4-methoxy-2-[(2R)-3-(4-methylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-(2-pyridin-3-yloxyethyl)azanium Openeye Name: [2-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]-4-methoxy-phenyl]methyl-[2-(3-pyridyloxy)ethyl]ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(4-methyl-1-piperazin-4-iumyl)propoxy]-4-methoxyphenyl]methyl-[2-(3-pyridinyloxy)ethyl]ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]-4-methoxyphenyl]methyl-(2-pyridin-3-yloxyethyl)azanium Traditional Name: [2-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]-4-methoxy-benzyl]-[2-(3-pyridyloxy)ethyl]ammonium Formula: C23H36N4O4+2 MolecularWeight: 432.55634

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(COC2=C(C=CC(=C2)OC)C[NH2+]CCOC3=CN=CC=C3)O

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@H](COC2=C(C=CC(=C2)OC)C[NH2+]CCOC3=CN=CC=C3)O

InChI

InChI=1S/C23H34N4O4/c1-26-9-11-27(12-10-26)17-20(28)18-31-23-14-21(29-2)6-5-19(23)15-25-8-13-30-22-4-3-7-24-16-22/h3-7,14,16,20,25,28H,8-13,15,17-18H2,1-2H3/p+2/t20-/m1/s1