6-[(E)-2-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 6-[(E)-2-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[(E)-2-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[(E)-2-(1,3-dimethyl-2-oxo-5-benzimidazolyl)ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[(E)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate Traditional Name: 4-keto-6-[(E)-2-(2-keto-1,3-dimethyl-benzimidazol-5-yl)vinyl]-5-nitro-1H-pyrimidin-2-olate Formula: C15H12N5O5- MolecularWeight: 342.28628

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=CC3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-])N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C=C/C3=C(C(=O)N=C(N3)[O-])[N+](=O)[O-])N(C1=O)C

InChI

InChI=1S/C15H13N5O5/c1-18-10-6-4-8(7-11(10)19(2)15(18)23)3-5-9-12(20(24)25)13(21)17-14(22)16-9/h3-7H,1-2H3,(H2,16,17,21,22)/p-1/b5-3+