(3R)-N-(furan-2-ylmethyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidine-1-carboxamide

Systemtic Name: (3R)-N-(furan-2-ylmethyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidine-1-carboxamide Openeye Name: (3R)-N-(2-furylmethyl)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidine-1-carboxamide CAS Name: (3R)-N-(2-furanylmethyl)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinecarboxamide IUPAC Name: (3R)-N-(furan-2-ylmethyl)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidine-1-carboxamide Traditional Name: (3R)-N-(2-furfuryl)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidine-1-carboxamide Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2CCN(C2)C(=O)NCC3=CC=CO3)CC4=CN=CC=C4

Isomeric SMILES

C1CN(C[C@H]1C2CC[NH+](CC2)CC3=CN=CC=C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H28N4O2/c26-21(23-14-20-4-2-12-27-20)25-11-7-19(16-25)18-5-9-24(10-6-18)15-17-3-1-8-22-13-17/h1-4,8,12-13,18-19H,5-7,9-11,14-16H2,(H,23,26)/p+1/t19-/m0/s1