N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-8-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-8-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-8-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-8-quinolinecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]quinoline-8-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-8-carboxamide Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=CC3=C2N=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=CC3=C2N=CC=C3)C4=CC=CO4

InChI

InChI=1S/C20H21N3O2/c24-20(16-8-3-6-15-7-4-10-21-19(15)16)22-14-17(18-9-5-13-25-18)23-11-1-2-12-23/h3-10,13,17H,1-2,11-12,14H2,(H,22,24)/p+1/t17-/m0/s1