6-[[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]pyridine-3-carbonitrile

Systemtic Name: 6-[[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]pyridine-3-carbonitrile Openeye Name: 6-[[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]pyridine-3-carbonitrile CAS Name: 6-[[(1S)-1-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-3-pyridinecarbonitrile IUPAC Name: 6-[[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-ylethyl]amino]pyridine-3-carbonitrile Traditional Name: 6-[[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]nicotinonitrile Formula: C18H21N4+ MolecularWeight: 293.38614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(C2=CC=CC=C2)NC3=NC=C(C=C3)C#N

Isomeric SMILES

C1CC[NH+](C1)C[C@H](C2=CC=CC=C2)NC3=NC=C(C=C3)C#N

InChI

InChI=1S/C18H20N4/c19-12-15-8-9-18(20-13-15)21-17(14-22-10-4-5-11-22)16-6-2-1-3-7-16/h1-3,6-9,13,17H,4-5,10-11,14H2,(H,20,21)/p+1/t17-/m1/s1