2-[4-[2-[5-nitro-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]ethenyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[2-[5-nitro-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]ethenyl]phenoxy]ethanoate Openeye Name: 2-[4-[2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)vinyl]phenoxy]acetate CAS Name: 2-[4-[2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate IUPAC Name: 2-[4-[2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]phenoxy]acetate Traditional Name: 2-[4-[2-(2,4-diketo-5-nitro-1H-pyrimidin-6-yl)vinyl]phenoxy]acetate Formula: C14H10N3O7- MolecularWeight: 332.2451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])OCC(=O)[O-]

InChI

InChI=1S/C14H11N3O7/c18-11(19)7-24-9-4-1-8(2-5-9)3-6-10-12(17(22)23)13(20)16-14(21)15-10/h1-6H,7H2,(H,18,19)(H2,15,16,20,21)/p-1