1-[4-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]propan-1-one Formula: C16H24NO4+ MolecularWeight: 294.36606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(C[NH+]2CCOCC2)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC[C@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C16H23NO4/c1-2-16(19)13-3-5-15(6-4-13)21-12-14(18)11-17-7-9-20-10-8-17/h3-6,14,18H,2,7-12H2,1H3/p+1/t14-/m0/s1