[(3S)-1-(3-ethylphenoxy)pentan-3-yl]azanium

Systemtic Name: [(3S)-1-(3-ethylphenoxy)pentan-3-yl]azanium Openeye Name: [(1S)-1-ethyl-3-(3-ethylphenoxy)propyl]ammonium CAS Name: [(3S)-1-(3-ethylphenoxy)pentan-3-yl]ammonium IUPAC Name: [(3S)-1-(3-ethylphenoxy)pentan-3-yl]azanium Traditional Name: [(1S)-1-ethyl-3-(3-ethylphenoxy)propyl]ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCCC(CC)[NH3+]

Isomeric SMILES

CCC1=CC(=CC=C1)OCC[C@H](CC)[NH3+]

InChI

InChI=1S/C13H21NO/c1-3-11-6-5-7-13(10-11)15-9-8-12(14)4-2/h5-7,10,12H,3-4,8-9,14H2,1-2H3/p+1/t12-/m0/s1