[(1S)-1-pyridin-3-ylethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]azanium

Systemtic Name: [(1S)-1-pyridin-3-ylethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]azanium Openeye Name: [(1S)-1-(3-pyridyl)ethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]ammonium CAS Name: [(1S)-1-(3-pyridinyl)ethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]ammonium IUPAC Name: [(1S)-1-pyridin-3-ylethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]azanium Traditional Name: [(1S)-1-(3-pyridyl)ethyl]-[(1S,5S)-3,3,5-trimethylcyclohexyl]ammonium Formula: C16H27N2+ MolecularWeight: 247.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)[NH2+]C(C)C2=CN=CC=C2

Isomeric SMILES

C[C@@H]1C[C@@H](CC(C1)(C)C)[NH2+][C@@H](C)C2=CN=CC=C2

InChI

InChI=1S/C16H26N2/c1-12-8-15(10-16(3,4)9-12)18-13(2)14-6-5-7-17-11-14/h5-7,11-13,15,18H,8-10H2,1-4H3/p+1/t12-,13+,15+/m1/s1