2-[(E)-2-anthracen-9-ylethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(E)-2-anthracen-9-ylethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(E)-2-(9-anthryl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 2-[(E)-2-(9-anthracenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one IUPAC Name: 2-[(E)-2-anthracen-9-ylethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Traditional Name: 2-[(E)-2-(9-anthryl)vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Formula: C20H13N3O4 MolecularWeight: 359.33492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=CC4=NC(=C(C(=O)N4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=C/C4=NC(=C(C(=O)N4)[N+](=O)[O-])O

InChI

InChI=1S/C20H13N3O4/c24-19-18(23(26)27)20(25)22-17(21-19)10-9-16-14-7-3-1-5-12(14)11-13-6-2-4-8-15(13)16/h1-11H,(H2,21,22,24,25)/b10-9+