(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)azepan-1-ium

Systemtic Name: (2S)-2-(pyrrolidin-1-ium-1-ylmethyl)azepan-1-ium Openeye Name: (2S)-2-(pyrrolidin-1-ium-1-ylmethyl)azepan-1-ium CAS Name: (2S)-2-(1-pyrrolidin-1-iumylmethyl)azepan-1-ium IUPAC Name: (2S)-2-(pyrrolidin-1-ium-1-ylmethyl)azepan-1-ium Traditional Name: (2S)-2-(pyrrolidin-1-ium-1-ylmethyl)azepan-1-ium Formula: C11H24N2+2 MolecularWeight: 184.32166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC([NH2+]CC1)C[NH+]2CCCC2

Isomeric SMILES

C1CC[C@H]([NH2+]CC1)C[NH+]2CCCC2

InChI

InChI=1S/C11H22N2/c1-2-6-11(12-7-3-1)10-13-8-4-5-9-13/h11-12H,1-10H2/p+2/t11-/m0/s1