[(1R,2R)-1-azaniumyl-1-phenyl-butan-2-yl]-dimethyl-azanium

Systemtic Name: [(1R,2R)-1-azaniumyl-1-phenyl-butan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-[(R)-azaniumyl(phenyl)methyl]propyl]-dimethyl-ammonium CAS Name: [(1R,2R)-1-ammonio-1-phenylbutan-2-yl]-dimethylammonium IUPAC Name: [(1R,2R)-1-azaniumyl-1-phenylbutan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-[(R)-ammonio(phenyl)methyl]propyl]-dimethyl-ammonium Formula: C12H22N2+2 MolecularWeight: 194.31648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2/c1-4-11(14(2)3)12(13)10-8-6-5-7-9-10/h5-9,11-12H,4,13H2,1-3H3/p+2/t11-,12-/m1/s1