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

Systemtic Name: 1H-pyrazol-4-yl-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Openeye Name: 1H-pyrazol-4-yl-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone CAS Name: 1H-pyrazol-4-yl-[(3R)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]methanone IUPAC Name: 1H-pyrazol-4-yl-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Traditional Name: 1H-pyrazol-4-yl-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidino]methanone Formula: C19H26N5O+ MolecularWeight: 340.44264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O/c25-19(18-11-21-22-12-18)24-9-5-17(14-24)16-3-7-23(8-4-16)13-15-2-1-6-20-10-15/h1-2,6,10-12,16-17H,3-5,7-9,13-14H2,(H,21,22)/p+1/t17-/m0/s1