[(2S)-heptan-2-yl]-[(1R)-1-pyridin-4-ylethyl]azanium

Systemtic Name: [(2S)-heptan-2-yl]-[(1R)-1-pyridin-4-ylethyl]azanium Openeye Name: [(1S)-1-methylhexyl]-[(1R)-1-(4-pyridyl)ethyl]ammonium CAS Name: [(2S)-heptan-2-yl]-[(1R)-1-pyridin-4-ylethyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-[(1R)-1-pyridin-4-ylethyl]azanium Traditional Name: [(1S)-1-methylhexyl]-[(1R)-1-(4-pyridyl)ethyl]ammonium Formula: C14H25N2+ MolecularWeight: 221.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]C(C)C1=CC=NC=C1

Isomeric SMILES

CCCCC[C@H](C)[NH2+][C@H](C)C1=CC=NC=C1

InChI

InChI=1S/C14H24N2/c1-4-5-6-7-12(2)16-13(3)14-8-10-15-11-9-14/h8-13,16H,4-7H2,1-3H3/p+1/t12-,13+/m0/s1