1-[5-[4-[(3R)-1-methylpyrrolidin-1-ium-3-yl]piperidin-1-yl]carbonyl-1H-pyrazol-3-yl]ethanone

Systemtic Name: 1-[5-[4-[(3R)-1-methylpyrrolidin-1-ium-3-yl]piperidin-1-yl]carbonyl-1H-pyrazol-3-yl]ethanone Openeye Name: 1-[5-[4-[(3R)-1-methylpyrrolidin-1-ium-3-yl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone CAS Name: 1-[5-[[4-[(3R)-1-methyl-3-pyrrolidin-1-iumyl]-1-piperidinyl]-oxomethyl]-1H-pyrazol-3-yl]ethanone IUPAC Name: 1-[5-[4-[(3R)-1-methylpyrrolidin-1-ium-3-yl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone Traditional Name: 1-[5-[4-[(3R)-1-methylpyrrolidin-1-ium-3-yl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone Formula: C16H25N4O2+ MolecularWeight: 305.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NNC(=C1)C(=O)N2CCC(CC2)C3CC[NH+](C3)C

Isomeric SMILES

CC(=O)C1=NNC(=C1)C(=O)N2CCC(CC2)[C@H]3CC[NH+](C3)C

InChI

InChI=1S/C16H24N4O2/c1-11(21)14-9-15(18-17-14)16(22)20-7-4-12(5-8-20)13-3-6-19(2)10-13/h9,12-13H,3-8,10H2,1-2H3,(H,17,18)/p+1/t13-/m0/s1