[(1S)-2-azaniumyl-1-pyridin-3-yl-ethyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-pyridin-3-yl-ethyl]-bis(2-methylpropyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-pyridyl)ethyl]-diisobutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-pyridinyl)ethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-pyridin-3-ylethyl]-bis(2-methylpropyl)azanium Traditional Name: [(1S)-2-ammonio-1-(3-pyridyl)ethyl]-diisobutyl-ammonium Formula: C15H29N3+2 MolecularWeight: 251.41086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H27N3/c1-12(2)10-18(11-13(3)4)15(8-16)14-6-5-7-17-9-14/h5-7,9,12-13,15H,8,10-11,16H2,1-4H3/p+2/t15-/m1/s1