(2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]azepan-1-ium

Systemtic Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]azepan-1-ium Openeye Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]azepan-1-ium CAS Name: (2S)-2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]azepan-1-ium IUPAC Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]azepan-1-ium Traditional Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]azepan-1-ium Formula: C13H28N2+2 MolecularWeight: 212.37482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2CCCCC[NH2+]2

Isomeric SMILES

C[C@H]1CCCC[NH+]1C[C@@H]2CCCCC[NH2+]2

InChI

InChI=1S/C13H26N2/c1-12-7-4-6-10-15(12)11-13-8-3-2-5-9-14-13/h12-14H,2-11H2,1H3/p+2/t12-,13-/m0/s1