[(3S)-1-(3-ethylphenoxy)-4-methyl-pentan-3-yl]azanium

Systemtic Name: [(3S)-1-(3-ethylphenoxy)-4-methyl-pentan-3-yl]azanium Openeye Name: [(1S)-1-[2-(3-ethylphenoxy)ethyl]-2-methyl-propyl]ammonium CAS Name: [(3S)-1-(3-ethylphenoxy)-4-methylpentan-3-yl]ammonium IUPAC Name: [(3S)-1-(3-ethylphenoxy)-4-methylpentan-3-yl]azanium Traditional Name: [(1S)-1-[2-(3-ethylphenoxy)ethyl]-2-methyl-propyl]ammonium Formula: C14H24NO+ MolecularWeight: 222.34646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO/c1-4-12-6-5-7-13(10-12)16-9-8-14(15)11(2)3/h5-7,10-11,14H,4,8-9,15H2,1-3H3/p+1/t14-/m0/s1