5-azanyl-6-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]carbonyl-4-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-azanyl-6-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]carbonyl-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-amino-6-[2-(4-methyl-2-nitro-anilino)-2-oxo-ethoxy]carbonyl-4-oxo-1H-pyrimidin-2-olate CAS Name: 5-amino-6-[[2-(4-methyl-2-nitroanilino)-2-oxoethoxy]-oxomethyl]-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-amino-6-[2-(4-methyl-2-nitroanilino)-2-oxoethoxy]carbonyl-4-oxo-1H-pyrimidin-2-olate Traditional Name: 5-amino-4-keto-6-[2-keto-2-(4-methyl-2-nitro-anilino)ethoxy]carbonyl-1H-pyrimidin-2-olate Formula: C14H12N5O7- MolecularWeight: 362.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C(=O)N=C(N2)[O-])N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=C(C(=O)N=C(N2)[O-])N)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O7/c1-6-2-3-7(8(4-6)19(24)25)16-9(20)5-26-13(22)11-10(15)12(21)18-14(23)17-11/h2-4H,5,15H2,1H3,(H,16,20)(H2,17,18,21,23)/p-1