2-[4-[2,2-bis(chloranyl)ethanoylamino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-[4-[2,2-bis(chloranyl)ethanoylamino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-[4-[(2,2-dichloroacetyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[4-[(2,2-dichloro-1-oxoethyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[4-[(2,2-dichloroacetyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-[4-[(2,2-dichloroacetyl)amino]phenyl]-6-keto-1H-pyrimidine-5-carboxylic acid Formula: C13H9Cl2N3O4 MolecularWeight: 342.13426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C(=O)N2)C(=O)O)NC(=O)C(Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C(=O)N2)C(=O)O)NC(=O)C(Cl)Cl

InChI

InChI=1S/C13H9Cl2N3O4/c14-9(15)12(20)17-7-3-1-6(2-4-7)10-16-5-8(13(21)22)11(19)18-10/h1-5,9H,(H,17,20)(H,21,22)(H,16,18,19)