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

Systemtic Name: 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-propyl-pyrimidin-1-yl]cyclohexa-1,4-diene-1-carboxylate Openeye Name: 2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-propyl-pyrimidin-1-yl)cyclohexa-1,4-diene-1-carboxylate CAS Name: 2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-propyl-1-pyrimidinyl)-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: 2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-propylpyrimidin-1-yl)cyclohexa-1,4-diene-1-carboxylate Traditional Name: 2-chloro-5-(2,6-diketo-3-methyl-4-propyl-pyrimidin-1-yl)-4-fluoro-cyclohexa-1,4-diene-1-carboxylate Formula: C15H15ClFN2O4- MolecularWeight: 341.742003

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N(C(=O)N1C)C2=C(CC(=C(C2)C(=O)[O-])Cl)F

Isomeric SMILES

CCCC1=CC(=O)N(C(=O)N1C)C2=C(CC(=C(C2)C(=O)[O-])Cl)F

InChI

InChI=1S/C15H16ClFN2O4/c1-3-4-8-5-13(20)19(15(23)18(8)2)12-6-9(14(21)22)10(16)7-11(12)17/h5H,3-4,6-7H2,1-2H3,(H,21,22)/p-1