(2R)-1-morpholin-4-yl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: (2R)-1-morpholin-4-yl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanone Openeye Name: (2R)-1-morpholino-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanone CAS Name: (2R)-1-(4-morpholinyl)-2-phenyl-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: (2R)-1-morpholin-4-yl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanone Traditional Name: (2R)-1-morpholino-2-phenyl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]ethanone Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)N3CCOCC3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)N3CCOCC3)C4=NC=CC=N4

InChI

InChI=1S/C20H25N5O2/c26-19(24-13-15-27-16-14-24)18(17-5-2-1-3-6-17)23-9-11-25(12-10-23)20-21-7-4-8-22-20/h1-8,18H,9-16H2/p+1/t18-/m1/s1