8-chloranyl-1-methyl-2,6-bis(oxidanylidene)-7H-purine-3-carboxylate

Systemtic Name: 8-chloranyl-1-methyl-2,6-bis(oxidanylidene)-7H-purine-3-carboxylate Openeye Name: 8-chloro-1-methyl-2,6-dioxo-7H-purine-3-carboxylate CAS Name: 8-chloro-1-methyl-2,6-dioxo-7H-purine-3-carboxylate IUPAC Name: 8-chloro-1-methyl-2,6-dioxo-7H-purine-3-carboxylate Traditional Name: 8-chloro-2,6-diketo-1-methyl-7H-purine-3-carboxylate Formula: C7H4ClN4O4- MolecularWeight: 243.58406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2)Cl)N(C1=O)C(=O)[O-]

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2)Cl)N(C1=O)C(=O)[O-]

InChI

InChI=1S/C7H5ClN4O4/c1-11-4(13)2-3(10-5(8)9-2)12(6(11)14)7(15)16/h1H3,(H,9,10)(H,15,16)/p-1