[(2S)-2-[butyl(methyl)amino]-2-pyridin-4-yl-ethyl]azanium

Systemtic Name: [(2S)-2-[butyl(methyl)amino]-2-pyridin-4-yl-ethyl]azanium Openeye Name: [(2S)-2-[butyl(methyl)amino]-2-(4-pyridyl)ethyl]ammonium CAS Name: [(2S)-2-[butyl(methyl)amino]-2-pyridin-4-ylethyl]ammonium IUPAC Name: [(2S)-2-[butyl(methyl)amino]-2-pyridin-4-ylethyl]azanium Traditional Name: [(2S)-2-[butyl(methyl)amino]-2-(4-pyridyl)ethyl]ammonium Formula: C12H22N3+ MolecularWeight: 208.32318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(C[NH3+])C1=CC=NC=C1

Isomeric SMILES

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

InChI

InChI=1S/C12H21N3/c1-3-4-9-15(2)12(10-13)11-5-7-14-8-6-11/h5-8,12H,3-4,9-10,13H2,1-2H3/p+1/t12-/m1/s1