2-chloranyl-5-[3,4-dimethyl-5-nitro-2,6-bis(oxidanylidene)pyrimidin-1-yl]-4-fluoranyl-cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: 2-chloranyl-5-[3,4-dimethyl-5-nitro-2,6-bis(oxidanylidene)pyrimidin-1-yl]-4-fluoranyl-cyclohexa-1,4-diene-1-carboxylate Openeye Name: 2-chloro-5-(3,4-dimethyl-5-nitro-2,6-dioxo-pyrimidin-1-yl)-4-fluoro-cyclohexa-1,4-diene-1-carboxylate CAS Name: 2-chloro-5-(3,4-dimethyl-5-nitro-2,6-dioxo-1-pyrimidinyl)-4-fluoro-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: 2-chloro-5-(3,4-dimethyl-5-nitro-2,6-dioxopyrimidin-1-yl)-4-fluorocyclohexa-1,4-diene-1-carboxylate Traditional Name: 2-chloro-5-(2,6-diketo-3,4-dimethyl-5-nitro-pyrimidin-1-yl)-4-fluoro-cyclohexa-1,4-diene-1-carboxylate Formula: C13H10ClFN3O6- MolecularWeight: 358.686403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)N1C)C2=C(CC(=C(C2)C(=O)[O-])Cl)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(C(=O)N1C)C2=C(CC(=C(C2)C(=O)[O-])Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClFN3O6/c1-5-10(18(23)24)11(19)17(13(22)16(5)2)9-3-6(12(20)21)7(14)4-8(9)15/h3-4H2,1-2H3,(H,20,21)/p-1