[(2S,3S)-2-(2-phenoxyethoxy)pentan-3-yl]azanium

Systemtic Name: [(2S,3S)-2-(2-phenoxyethoxy)pentan-3-yl]azanium Openeye Name: [(1S,2S)-1-ethyl-2-(2-phenoxyethoxy)propyl]ammonium CAS Name: [(2S,3S)-2-(2-phenoxyethoxy)pentan-3-yl]ammonium IUPAC Name: [(2S,3S)-2-(2-phenoxyethoxy)pentan-3-yl]azanium Traditional Name: [(1S,2S)-1-ethyl-2-(2-phenoxyethoxy)propyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)OCCOC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CC[C@@H]([C@H](C)OCCOC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C13H21NO2/c1-3-13(14)11(2)15-9-10-16-12-7-5-4-6-8-12/h4-8,11,13H,3,9-10,14H2,1-2H3/p+1/t11-,13-/m0/s1