[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C17H36N2+2 MolecularWeight: 268.48114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CCC[NH+]2CCCC2)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)[NH2+]CCC[NH+]2CCCC2)C(C)C

InChI

InChI=1S/C17H34N2/c1-14(2)16-8-7-15(3)13-17(16)18-9-6-12-19-10-4-5-11-19/h14-18H,4-13H2,1-3H3/p+2/t15-,16+,17-/m0/s1