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

Systemtic Name: [(2S)-1-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-4-methyl-pentan-2-yl]azanium Openeye Name: [(1S)-1-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-4-methylpentan-2-yl]ammonium IUPAC Name: [(2S)-1-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-4-methylpentan-2-yl]azanium Traditional Name: [(1S)-1-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-3-methyl-butyl]ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2/c1-10(2)5-13(14)9-15-7-11(3)6-12(4)8-15/h10-13H,5-9,14H2,1-4H3/p+2/t11-,12-,13+/m1/s1