[(1R)-2-[(2S)-2-ethylhexoxy]-1-(4-methylphenyl)ethyl]azanium

Systemtic Name: [(1R)-2-[(2S)-2-ethylhexoxy]-1-(4-methylphenyl)ethyl]azanium Openeye Name: [(1R)-2-[(2S)-2-ethylhexoxy]-1-(p-tolyl)ethyl]ammonium CAS Name: [(1R)-2-[(2S)-2-ethylhexoxy]-1-(4-methylphenyl)ethyl]ammonium IUPAC Name: [(1R)-2-[(2S)-2-ethylhexoxy]-1-(4-methylphenyl)ethyl]azanium Traditional Name: [(1R)-2-[(2S)-2-ethylhexoxy]-1-(p-tolyl)ethyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC(C1=CC=C(C=C1)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO/c1-4-6-7-15(5-2)12-19-13-17(18)16-10-8-14(3)9-11-16/h8-11,15,17H,4-7,12-13,18H2,1-3H3/p+1/t15-,17-/m0/s1