5-bromanyl-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]nicotinamide Formula: C16H19BrN3O2+ MolecularWeight: 365.24496

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC(=CN=C2)Br)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC(=CN=C2)Br)C3=CC=CO3

InChI

InChI=1S/C16H18BrN3O2/c17-13-8-12(9-18-10-13)16(21)19-11-14(15-4-3-7-22-15)20-5-1-2-6-20/h3-4,7-10,14H,1-2,5-6,11H2,(H,19,21)/p+1/t14-/m0/s1