(2R)-1-(3-methoxyphenoxy)-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(3-methoxyphenoxy)-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol Openeye Name: (2R)-1-(3-methoxyphenoxy)-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol CAS Name: (2R)-1-(3-methoxyphenoxy)-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-propanol IUPAC Name: (2R)-1-(3-methoxyphenoxy)-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-2-ol Traditional Name: (2R)-1-(3-methoxyphenoxy)-3-(4-pyridin-1-ium-2-ylpiperazino)propan-2-ol Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC(CN2CCN(CC2)C3=CC=CC=[NH+]3)O

Isomeric SMILES

COC1=CC(=CC=C1)OC[C@@H](CN2CCN(CC2)C3=CC=CC=[NH+]3)O

InChI

InChI=1S/C19H25N3O3/c1-24-17-5-4-6-18(13-17)25-15-16(23)14-21-9-11-22(12-10-21)19-7-2-3-8-20-19/h2-8,13,16,23H,9-12,14-15H2,1H3/p+1/t16-/m1/s1