[(1R)-1-(2-methylphenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium

Systemtic Name: [(1R)-1-(2-methylphenyl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium Openeye Name: [(1R)-2-[(1S)-1-methylheptoxy]-1-(o-tolyl)ethyl]ammonium CAS Name: [(1R)-1-(2-methylphenyl)-2-[(2S)-octan-2-yl]oxyethyl]ammonium IUPAC Name: [(1R)-1-(2-methylphenyl)-2-[(2S)-octan-2-yl]oxyethyl]azanium Traditional Name: [(1R)-2-[(1S)-1-methylheptoxy]-1-(o-tolyl)ethyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC(C1=CC=CC=C1C)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OC[C@@H](C1=CC=CC=C1C)[NH3+]

InChI

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