[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-thiophen-2-yl-methanone Openeye Name: [(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-(2-thienyl)methanone CAS Name: [(3R)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]-thiophen-2-ylmethanone IUPAC Name: [(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-thiophen-2-ylmethanone Traditional Name: [(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidino]-(2-thienyl)methanone Formula: C20H26N3OS+ MolecularWeight: 356.50494

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2CCN(C2)C(=O)C3=CC=CS3)CC4=CN=CC=C4

Isomeric SMILES

C1CN(C[C@H]1C2CC[NH+](CC2)CC3=CN=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H25N3OS/c24-20(19-4-2-12-25-19)23-11-7-18(15-23)17-5-9-22(10-6-17)14-16-3-1-8-21-13-16/h1-4,8,12-13,17-18H,5-7,9-11,14-15H2/p+1/t18-/m0/s1