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

Systemtic Name: [(1S)-1-(1-benzofuran-2-yl)-2-[(2S)-octan-2-yl]oxy-ethyl]azanium Openeye Name: [(1S)-1-(benzofuran-2-yl)-2-[(1S)-1-methylheptoxy]ethyl]ammonium CAS Name: [(1S)-1-(2-benzofuranyl)-2-[(2S)-octan-2-yl]oxyethyl]ammonium IUPAC Name: [(1S)-1-(1-benzofuran-2-yl)-2-[(2S)-octan-2-yl]oxyethyl]azanium Traditional Name: [(1S)-1-(benzofuran-2-yl)-2-[(1S)-1-methylheptoxy]ethyl]ammonium Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC(C1=CC2=CC=CC=C2O1)[NH3+]

Isomeric SMILES

CCCCCC[C@H](C)OC[C@@H](C1=CC2=CC=CC=C2O1)[NH3+]

InChI

InChI=1S/C18H27NO2/c1-3-4-5-6-9-14(2)20-13-16(19)18-12-15-10-7-8-11-17(15)21-18/h7-8,10-12,14,16H,3-6,9,13,19H2,1-2H3/p+1/t14-,16-/m0/s1