[(2S)-6-methylheptan-2-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(2S)-6-methylheptan-2-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-(3-pyridylmethyl)ammonium CAS Name: [(2S)-6-methylheptan-2-yl]-(3-pyridinylmethyl)ammonium IUPAC Name: [(2S)-6-methylheptan-2-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-(3-pyridylmethyl)ammonium Formula: C14H25N2+ MolecularWeight: 221.3617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)[NH2+]CC1=CN=CC=C1

Isomeric SMILES

C[C@@H](CCCC(C)C)[NH2+]CC1=CN=CC=C1

InChI

InChI=1S/C14H24N2/c1-12(2)6-4-7-13(3)16-11-14-8-5-9-15-10-14/h5,8-10,12-13,16H,4,6-7,11H2,1-3H3/p+1/t13-/m0/s1