6-chloranyl-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-chloranyl-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine CAS Name: 6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine Traditional Name: 6-chloro-1-methyl-4-(4-nitrophenoxy)pyrazolo[3,4-d]pyrimidine Formula: C12H8ClN5O3 MolecularWeight: 305.67662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)Cl)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)Cl)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN5O3/c1-17-10-9(6-14-17)11(16-12(13)15-10)21-8-4-2-7(3-5-8)18(19)20/h2-6H,1H3