6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile

Systemtic Name: 6-azanyl-4-(2-chloranyl-6-fluoranyl-phenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Openeye Name: 6-amino-4-(2-chloro-6-fluoro-phenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile CAS Name: 6-amino-4-(2-chloro-6-fluorophenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile IUPAC Name: 6-amino-4-(2-chloro-6-fluorophenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Traditional Name: 6-amino-4-(2-chloro-6-fluoro-phenyl)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Formula: C20H14ClFN5+ MolecularWeight: 378.810063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=NC2=[N+](N1)C3=CC=CC=C3)N)C#N)C4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C2C(=C(C(=NC2=[N+](N1)C3=CC=CC=C3)N)C#N)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C20H13ClFN5/c1-11-16-17(18-14(21)8-5-9-15(18)22)13(10-23)19(24)25-20(16)27(26-11)12-6-3-2-4-7-12/h2-9H,1H3,(H2,24,25,26)/p+1