[(1R,2R)-1-azaniumyl-1-phenyl-butan-2-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(1R,2R)-1-azaniumyl-1-phenyl-butan-2-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1R)-1-[(R)-azaniumyl(phenyl)methyl]propyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(1R,2R)-1-ammonio-1-phenylbutan-2-yl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(1R,2R)-1-azaniumyl-1-phenylbutan-2-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1R)-1-[(R)-ammonio(phenyl)methyl]propyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C18H27N3+2 MolecularWeight: 285.42708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)[NH3+])[NH+](C)CCC2=CC=CC=N2

Isomeric SMILES

CC[C@H]([C@@H](C1=CC=CC=C1)[NH3+])[NH+](C)CCC2=CC=CC=N2

InChI

InChI=1S/C18H25N3/c1-3-17(18(19)15-9-5-4-6-10-15)21(2)14-12-16-11-7-8-13-20-16/h4-11,13,17-18H,3,12,14,19H2,1-2H3/p+2/t17-,18-/m1/s1