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

Systemtic Name: (5-methyl-1H-pyrazol-4-yl)-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Openeye Name: (5-methyl-1H-pyrazol-4-yl)-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone CAS Name: (5-methyl-1H-pyrazol-4-yl)-[(3R)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]methanone IUPAC Name: (5-methyl-1H-pyrazol-4-yl)-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Traditional Name: (5-methyl-1H-pyrazol-4-yl)-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidino]methanone Formula: C20H28N5O+ MolecularWeight: 354.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)N2CCC(C2)C3CC[NH+](CC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=NN1)C(=O)N2CC[C@@H](C2)C3CC[NH+](CC3)CC4=CN=CC=C4

InChI

InChI=1S/C20H27N5O/c1-15-19(12-22-23-15)20(26)25-10-6-18(14-25)17-4-8-24(9-5-17)13-16-3-2-7-21-11-16/h2-3,7,11-12,17-18H,4-6,8-10,13-14H2,1H3,(H,22,23)/p+1/t18-/m0/s1