4-chloranyl-1,6-dimethyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-chloranyl-1,6-dimethyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-chloro-1,6-dimethyl-3-(5-nitro-2-furyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-chloro-1,6-dimethyl-3-(5-nitro-2-furanyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-chloro-1,6-dimethyl-3-(5-nitrofuran-2-yl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-chloro-1,6-dimethyl-3-(5-nitro-2-furyl)pyrazolo[3,4-d]pyrimidine Formula: C11H8ClN5O3 MolecularWeight: 293.66592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C)C3=CC=C(O3)[N+](=O)[O-])C(=N1)Cl

Isomeric SMILES

CC1=NC2=C(C(=NN2C)C3=CC=C(O3)[N+](=O)[O-])C(=N1)Cl

InChI

InChI=1S/C11H8ClN5O3/c1-5-13-10(12)8-9(15-16(2)11(8)14-5)6-3-4-7(20-6)17(18)19/h3-4H,1-2H3