[(2S,3S)-2-(4-methylphenoxy)pentan-3-yl]azanium

Systemtic Name: [(2S,3S)-2-(4-methylphenoxy)pentan-3-yl]azanium Openeye Name: [(1S,2S)-1-ethyl-2-(4-methylphenoxy)propyl]ammonium CAS Name: [(2S,3S)-2-(4-methylphenoxy)pentan-3-yl]ammonium IUPAC Name: [(2S,3S)-2-(4-methylphenoxy)pentan-3-yl]azanium Traditional Name: [(1S,2S)-1-ethyl-2-(4-methylphenoxy)propyl]ammonium Formula: C12H20NO+ MolecularWeight: 194.2933

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)OC1=CC=C(C=C1)C)[NH3+]

Isomeric SMILES

CC[C@@H]([C@H](C)OC1=CC=C(C=C1)C)[NH3+]

InChI

InChI=1S/C12H19NO/c1-4-12(13)10(3)14-11-7-5-9(2)6-8-11/h5-8,10,12H,4,13H2,1-3H3/p+1/t10-,12-/m0/s1