[(3S)-1-(2,3,6-trimethylphenoxy)pentan-3-yl]azanium

Systemtic Name: [(3S)-1-(2,3,6-trimethylphenoxy)pentan-3-yl]azanium Openeye Name: [(1S)-1-ethyl-3-(2,3,6-trimethylphenoxy)propyl]ammonium CAS Name: [(3S)-1-(2,3,6-trimethylphenoxy)pentan-3-yl]ammonium IUPAC Name: [(3S)-1-(2,3,6-trimethylphenoxy)pentan-3-yl]azanium Traditional Name: [(1S)-1-ethyl-3-(2,3,6-trimethylphenoxy)propyl]ammonium Formula: C14H24NO+ MolecularWeight: 222.34646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCOC1=C(C=CC(=C1C)C)C)[NH3+]

Isomeric SMILES

CC[C@@H](CCOC1=C(C=CC(=C1C)C)C)[NH3+]

InChI

InChI=1S/C14H23NO/c1-5-13(15)8-9-16-14-11(3)7-6-10(2)12(14)4/h6-7,13H,5,8-9,15H2,1-4H3/p+1/t13-/m0/s1