[(2R)-2-(dimethylamino)-2-phenyl-ethyl]-[(2S)-octan-2-yl]azanium

Systemtic Name: [(2R)-2-(dimethylamino)-2-phenyl-ethyl]-[(2S)-octan-2-yl]azanium Openeye Name: [(2R)-2-(dimethylamino)-2-phenyl-ethyl]-[(1S)-1-methylheptyl]ammonium CAS Name: [(2R)-2-(dimethylamino)-2-phenylethyl]-[(2S)-octan-2-yl]ammonium IUPAC Name: [(2R)-2-(dimethylamino)-2-phenylethyl]-[(2S)-octan-2-yl]azanium Traditional Name: [(2R)-2-(dimethylamino)-2-phenyl-ethyl]-[(1S)-1-methylheptyl]ammonium Formula: C18H33N2+ MolecularWeight: 277.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CC(C1=CC=CC=C1)N(C)C

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]C[C@@H](C1=CC=CC=C1)N(C)C

InChI

InChI=1S/C18H32N2/c1-5-6-7-9-12-16(2)19-15-18(20(3)4)17-13-10-8-11-14-17/h8,10-11,13-14,16,18-19H,5-7,9,12,15H2,1-4H3/p+1/t16-,18-/m0/s1