1-[(2S)-3-[3-(1,2-oxazolidin-2-ylmethyl)phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(2S)-3-[3-(1,2-oxazolidin-2-ylmethyl)phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2S)-2-hydroxy-3-[3-(isoxazolidin-2-ylmethyl)phenoxy]propyl]piperidin-1-ium-4-ol CAS Name: 1-[(2S)-2-hydroxy-3-[3-(2-isoxazolidinylmethyl)phenoxy]propyl]-4-piperidin-1-iumol IUPAC Name: 1-[(2S)-2-hydroxy-3-[3-(1,2-oxazolidin-2-ylmethyl)phenoxy]propyl]piperidin-1-ium-4-ol Traditional Name: 1-[(2S)-2-hydroxy-3-[3-(isoxazolidin-2-ylmethyl)phenoxy]propyl]piperidin-1-ium-4-ol Formula: C18H29N2O4+ MolecularWeight: 337.43386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(OC1)CC2=CC(=CC=C2)OCC(C[NH+]3CCC(CC3)O)O

Isomeric SMILES

C1CN(OC1)CC2=CC(=CC=C2)OC[C@H](C[NH+]3CCC(CC3)O)O

InChI

InChI=1S/C18H28N2O4/c21-16-5-8-19(9-6-16)13-17(22)14-23-18-4-1-3-15(11-18)12-20-7-2-10-24-20/h1,3-4,11,16-17,21-22H,2,5-10,12-14H2/p+1/t17-/m0/s1