6-[(E)-2-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 6-[(E)-2-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[(E)-2-[4-(2-amino-2-oxo-ethoxy)phenyl]vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[(E)-2-[4-(2-amino-2-oxoethoxy)phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[(E)-2-[4-(2-amino-2-oxoethoxy)phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[(E)-2-[4-(2-amino-2-keto-ethoxy)phenyl]vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C14H11N4O6- MolecularWeight: 331.26034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])OCC(=O)N

InChI

InChI=1S/C14H12N4O6/c15-11(19)7-24-9-4-1-8(2-5-9)3-6-10-12(18(22)23)13(20)17-14(21)16-10/h1-6H,7H2,(H2,15,19)(H2,16,17,20,21)/p-1/b6-3+