5-chloranyl-6-oxidanyl-4-oxidanylidene-3H-[1]benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile

Systemtic Name: 5-chloranyl-6-oxidanyl-4-oxidanylidene-3H-[1]benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile Openeye Name: 5-chloro-6-hydroxy-4-oxo-3H-benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile CAS Name: 5-chloro-6-hydroxy-4-oxo-3H-benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile IUPAC Name: 5-chloro-6-hydroxy-4-oxo-3H-[1]benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile Traditional Name: 5-chloro-6-hydroxy-4-keto-3H-benzofuro[2,3-d]pyrimidine-7,8-dicarbonitrile Formula: C12H3ClN4O3 MolecularWeight: 286.63022

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C3=C(O2)C(=C(C(=C3Cl)O)C#N)C#N)C(=O)N1

Isomeric SMILES

C1=NC2=C(C3=C(O2)C(=C(C(=C3Cl)O)C#N)C#N)C(=O)N1

InChI

InChI=1S/C12H3ClN4O3/c13-8-6-7-11(19)16-3-17-12(7)20-10(6)5(2-15)4(1-14)9(8)18/h3,18H,(H,16,17,19)