[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-(2-pyridin-2-ylethyl)azanium Traditional Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-[2-(2-pyridyl)ethyl]ammonium Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CCC2=CC=CC=N2)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)[NH2+]CCC2=CC=CC=N2)C(C)C

InChI

InChI=1S/C17H28N2/c1-13(2)16-8-7-14(3)12-17(16)19-11-9-15-6-4-5-10-18-15/h4-6,10,13-14,16-17,19H,7-9,11-12H2,1-3H3/p+1/t14-,16+,17-/m0/s1