2-azanyl-5-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylidene]-1,3-dimethyl-pyrimidin-1-ium-4,6-dione

Systemtic Name: 2-azanyl-5-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylidene]-1,3-dimethyl-pyrimidin-1-ium-4,6-dione Openeye Name: 2-amino-5-[(3,5-dichloro-2-hydroxy-phenyl)methylene]-1,3-dimethyl-pyrimidin-1-ium-4,6-dione CAS Name: 2-amino-5-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-1,3-dimethylpyrimidin-1-ium-4,6-dione IUPAC Name: 2-amino-5-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-1,3-dimethylpyrimidin-1-ium-4,6-dione Traditional Name: 2-amino-5-(3,5-dichloro-2-hydroxy-benzylidene)-1,3-dimethyl-pyrimidin-1-ium-4,6-quinone Formula: C13H12Cl2N3O3+ MolecularWeight: 329.15868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=CC(=C2O)Cl)Cl)C(=O)[N+](=C1N)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=CC(=C2O)Cl)Cl)C(=O)[N+](=C1N)C

InChI

InChI=1S/C13H11Cl2N3O3/c1-17-11(20)8(12(21)18(2)13(17)16)4-6-3-7(14)5-9(15)10(6)19/h3-5,16H,1-2H3,(H,19,20,21)/p+1