3-chloranyl-5-oxidanidyl-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium

Systemtic Name: 3-chloranyl-5-oxidanidyl-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium Openeye Name: 3-chloro-5-oxido-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium CAS Name: 3-chloro-5-oxido-2-phenylpyrazolo[3,4-d]pyrimidin-5-ium IUPAC Name: 3-chloro-5-oxido-2-phenylpyrazolo[3,4-d]pyrimidin-5-ium Traditional Name: 3-chloro-5-oxido-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium Formula: C11H7ClN4O MolecularWeight: 246.65248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C3C=[N+](C=NC3=N2)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C3C=[N+](C=NC3=N2)[O-])Cl

InChI

InChI=1S/C11H7ClN4O/c12-10-9-6-15(17)7-13-11(9)14-16(10)8-4-2-1-3-5-8/h1-7H