5-nitro-4-oxidanylidene-6-[(E)-2-[5-(1-oxidanylidene-3H-2-benzofuran-5-yl)furan-2-yl]ethenyl]-1H-pyrimidin-2-olate

Systemtic Name: 5-nitro-4-oxidanylidene-6-[(E)-2-[5-(1-oxidanylidene-3H-2-benzofuran-5-yl)furan-2-yl]ethenyl]-1H-pyrimidin-2-olate Openeye Name: 5-nitro-4-oxo-6-[(E)-2-[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furyl]vinyl]-1H-pyrimidin-2-olate CAS Name: 5-nitro-4-oxo-6-[(E)-2-[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furanyl]ethenyl]-1H-pyrimidin-2-olate IUPAC Name: 5-nitro-4-oxo-6-[(E)-2-[5-(1-oxo-3H-2-benzofuran-5-yl)furan-2-yl]ethenyl]-1H-pyrimidin-2-olate Traditional Name: 4-keto-6-[(E)-2-[5-(1-ketophthalan-5-yl)-2-furyl]vinyl]-5-nitro-1H-pyrimidin-2-olate Formula: C18H10N3O7- MolecularWeight: 380.2879

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C3=CC=C(O3)C=CC4=C(C(=O)N=C(N4)[O-])[N+](=O)[O-])C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)C3=CC=C(O3)/C=C/C4=C(C(=O)N=C(N4)[O-])[N+](=O)[O-])C(=O)O1

InChI

InChI=1S/C18H11N3O7/c22-16-15(21(25)26)13(19-18(24)20-16)5-2-11-3-6-14(28-11)9-1-4-12-10(7-9)8-27-17(12)23/h1-7H,8H2,(H2,19,20,22,24)/p-1/b5-2+