2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C16H26N5O2+ MolecularWeight: 320.40994

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H25N5O2/c1-13-10-19(11-14(2)23-13)12-15(22)20-6-8-21(9-7-20)16-17-4-3-5-18-16/h3-5,13-14H,6-12H2,1-2H3/p+1/t13-,14-/m1/s1