5-[(3,4-dichlorophenyl)carbamoyl]-1,3-dimethyl-6-oxidanylidene-pyrimidin-3-ium-4-olate

Systemtic Name: 5-[(3,4-dichlorophenyl)carbamoyl]-1,3-dimethyl-6-oxidanylidene-pyrimidin-3-ium-4-olate Openeye Name: 5-[(3,4-dichlorophenyl)carbamoyl]-1,3-dimethyl-6-oxo-pyrimidin-3-ium-4-olate CAS Name: 5-[(3,4-dichloroanilino)-oxomethyl]-1,3-dimethyl-6-oxo-4-pyrimidin-3-iumolate IUPAC Name: 5-[(3,4-dichlorophenyl)carbamoyl]-1,3-dimethyl-6-oxopyrimidin-3-ium-4-olate Traditional Name: 5-[(3,4-dichlorophenyl)carbamoyl]-6-keto-1,3-dimethyl-pyrimidin-3-ium-4-olate Formula: C13H11Cl2N3O3 MolecularWeight: 328.15074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C(=C(C1=O)C(=O)NC2=CC(=C(C=C2)Cl)Cl)[O-])C

Isomeric SMILES

CN1C=[N+](C(=C(C1=O)C(=O)NC2=CC(=C(C=C2)Cl)Cl)[O-])C

InChI

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