4-[6-morpholin-4-yl-2-[4-(4-nitrophenyl)piperazin-1-yl]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-morpholin-4-yl-2-[4-(4-nitrophenyl)piperazin-1-yl]pyrimidin-4-yl]morpholine Openeye Name: 4-[6-morpholino-2-[4-(4-nitrophenyl)piperazin-1-yl]pyrimidin-4-yl]morpholine CAS Name: 4-[6-(4-morpholinyl)-2-[4-(4-nitrophenyl)-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-morpholin-4-yl-2-[4-(4-nitrophenyl)piperazin-1-yl]pyrimidin-4-yl]morpholine Traditional Name: 4-[6-morpholino-2-[4-(4-nitrophenyl)piperazino]pyrimidin-4-yl]morpholine Formula: C22H29N7O4 MolecularWeight: 455.51016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CC(=N3)N4CCOCC4)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=CC(=N3)N4CCOCC4)N5CCOCC5

InChI

InChI=1S/C22H29N7O4/c30-29(31)19-3-1-18(2-4-19)25-5-7-28(8-6-25)22-23-20(26-9-13-32-14-10-26)17-21(24-22)27-11-15-33-16-12-27/h1-4,17H,5-16H2