[(2S)-4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]butan-2-yl]azanium

Systemtic Name: [(2S)-4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]butan-2-yl]azanium Openeye Name: [(1S)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-methyl-propyl]ammonium CAS Name: [(2S)-4-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]butan-2-yl]ammonium IUPAC Name: [(2S)-4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]butan-2-yl]azanium Traditional Name: [(1S)-3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-methyl-propyl]ammonium Formula: C11H26N2+2 MolecularWeight: 186.33754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCC(C)[NH3+])C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC[C@H](C)[NH3+])C

InChI

InChI=1S/C11H24N2/c1-9-6-10(2)8-13(7-9)5-4-11(3)12/h9-11H,4-8,12H2,1-3H3/p+2/t9-,10-,11+/m1/s1