ethyl-[(2S)-3-(4-ethylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: ethyl-[(2S)-3-(4-ethylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: ethyl-[(2S)-3-(4-ethylphenoxy)-2-hydroxy-propyl]ammonium CAS Name: ethyl-[(2S)-3-(4-ethylphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: ethyl-[(2S)-3-(4-ethylphenoxy)-2-hydroxypropyl]azanium Traditional Name: ethyl-[(2S)-3-(4-ethylphenoxy)-2-hydroxy-propyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(C[NH2+]CC)O

Isomeric SMILES

CCC1=CC=C(C=C1)OC[C@H](C[NH2+]CC)O

InChI

InChI=1S/C13H21NO2/c1-3-11-5-7-13(8-6-11)16-10-12(15)9-14-4-2/h5-8,12,14-15H,3-4,9-10H2,1-2H3/p+1/t12-/m0/s1