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

Systemtic Name: 5-nitro-4-oxidanyl-2-[(E)-2-(5-phenylfuran-2-yl)ethenyl]-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-nitro-2-[(E)-2-(5-phenyl-2-furyl)vinyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-nitro-2-[(E)-2-(5-phenyl-2-furanyl)ethenyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-nitro-2-[(E)-2-(5-phenylfuran-2-yl)ethenyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-nitro-2-[(E)-2-(5-phenyl-2-furyl)vinyl]-1H-pyrimidin-6-one Formula: C16H11N3O5 MolecularWeight: 325.27564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11N3O5/c20-15-14(19(22)23)16(21)18-13(17-15)9-7-11-6-8-12(24-11)10-4-2-1-3-5-10/h1-9H,(H2,17,18,20,21)/b9-7+