6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]pyridine-3-carbonitrile

Systemtic Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]pyridine-3-carbonitrile Openeye Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]pyridine-3-carbonitrile CAS Name: 6-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]pyridine-3-carbonitrile Traditional Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]nicotinonitrile Formula: C13H19N4+ MolecularWeight: 231.31676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4/c1-2-17-7-3-4-12(17)10-16-13-6-5-11(8-14)9-15-13/h5-6,9,12H,2-4,7,10H2,1H3,(H,15,16)/p+1/t12-/m0/s1