N5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyridin-1-ium-2,5-diamine

Systemtic Name: N5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyridin-1-ium-2,5-diamine Openeye Name: N5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyridin-1-ium-2,5-diamine CAS Name: N5-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]amine Formula: C12H22N4+2 MolecularWeight: 222.32988

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=C[NH+]=C(C=C2)N

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC2=C[NH+]=C(C=C2)N

InChI

InChI=1S/C12H20N4/c1-2-16-7-3-4-11(16)9-14-10-5-6-12(13)15-8-10/h5-6,8,11,14H,2-4,7,9H2,1H3,(H2,13,15)/p+2/t11-/m0/s1