3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]carbonylamino]-4-chloranyl-benzoic acid

Systemtic Name: 3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]carbonylamino]-4-chloranyl-benzoic acid Openeye Name: 4-chloro-3-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(2,4-dioxo-1H-pyrimidin-6-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(2,4-diketo-1H-pyrimidine-6-carbonyl)amino]benzoic acid Formula: C12H8ClN3O5 MolecularWeight: 309.66202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=O)NC(=O)N2)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=O)NC(=O)N2)Cl

InChI

InChI=1S/C12H8ClN3O5/c13-6-2-1-5(11(19)20)3-7(6)14-10(18)8-4-9(17)16-12(21)15-8/h1-4H,(H,14,18)(H,19,20)(H2,15,16,17,21)