4-[(2R)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-4-ium-2-one

Systemtic Name: 4-[(2R)-3-(4-methoxyphenoxy)-2-oxidanyl-propyl]piperazin-4-ium-2-one Openeye Name: 4-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]piperazin-4-ium-2-one CAS Name: 4-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-2-piperazin-4-iumone IUPAC Name: 4-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]piperazin-4-ium-2-one Traditional Name: 4-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]piperazin-4-ium-2-one Formula: C14H21N2O4+ MolecularWeight: 281.32754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(C[NH+]2CCNC(=O)C2)O

Isomeric SMILES

COC1=CC=C(C=C1)OC[C@@H](C[NH+]2CCNC(=O)C2)O

InChI

InChI=1S/C14H20N2O4/c1-19-12-2-4-13(5-3-12)20-10-11(17)8-16-7-6-15-14(18)9-16/h2-5,11,17H,6-10H2,1H3,(H,15,18)/p+1/t11-/m1/s1