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

Systemtic Name: 5-nitro-4-oxidanylidene-6-[(E)-2-(5-phenylfuran-2-yl)ethenyl]-1H-pyrimidin-2-olate Openeye Name: 5-nitro-4-oxo-6-[(E)-2-(5-phenyl-2-furyl)vinyl]-1H-pyrimidin-2-olate CAS Name: 5-nitro-4-oxo-6-[(E)-2-(5-phenyl-2-furanyl)ethenyl]-1H-pyrimidin-2-olate IUPAC Name: 5-nitro-4-oxo-6-[(E)-2-(5-phenylfuran-2-yl)ethenyl]-1H-pyrimidin-2-olate Traditional Name: 4-keto-5-nitro-6-[(E)-2-(5-phenyl-2-furyl)vinyl]-1H-pyrimidin-2-olate Formula: C16H10N3O5- MolecularWeight: 324.2677

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(O2)C=CC3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(O2)/C=C/C3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O5/c20-15-14(19(22)23)12(17-16(21)18-15)8-6-11-7-9-13(24-11)10-4-2-1-3-5-10/h1-9H,(H2,17,18,20,21)/p-1/b8-6+