disodium (2E)-2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methylidene]-5-(4-bromophenyl)-3,6-dihydro-1,3,4-oxadiazin-6-olate

Systemtic Name: disodium (2E)-2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methylidene]-5-(4-bromophenyl)-3,6-dihydro-1,3,4-oxadiazin-6-olate Openeye Name: disodium (2E)-5-(4-bromophenyl)-2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylene]-3,6-dihydro-1,3,4-oxadiazin-6-olate CAS Name: disodium (2E)-5-(4-bromophenyl)-2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylidene]-3,6-dihydro-1,3,4-oxadiazin-6-olate IUPAC Name: disodium (2E)-5-(4-bromophenyl)-2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylidene]-3,6-dihydro-1,3,4-oxadiazin-6-olate Traditional Name: disodium (2E)-5-(4-bromophenyl)-2-[(2,4-diketo-1H-pyrimidin-5-yl)methylene]-3,6-dihydro-1,3,4-oxadiazin-6-olate Formula: C14H10BrN4Na2O4+ MolecularWeight: 424.13714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNC(=CC3=CNC(=O)NC3=O)OC2[O-])Br.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=NN/C(=C\C3=CNC(=O)NC3=O)/OC2[O-])Br.[Na+].[Na+]

InChI

InChI=1S/C14H10BrN4O4.2Na/c15-9-3-1-7(2-4-9)11-13(21)23-10(18-19-11)5-8-6-16-14(22)17-12(8)20;;/h1-6,13,18H,(H2,16,17,20,22);;/q-1;2*+1/b10-5+;;