4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-1H-pyrimidin-6-one

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-1H-pyrimidin-6-one Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-1H-pyrimidin-6-one CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-1H-pyrimidin-6-one Formula: C12H10ClN3O4 MolecularWeight: 295.6785

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H10ClN3O4/c1-6-3-8(4-7(2)9(6)13)20-12-10(16(18)19)11(17)14-5-15-12/h3-5H,1-2H3,(H,14,15,17)