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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)C(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

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