4-(2-bromanyl-3-nitro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 4-(2-bromanyl-3-nitro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 4-(2-bromo-3-nitro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 4-(2-bromo-3-nitrophenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 4-(2-bromo-3-nitrophenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 4-(2-bromo-3-nitro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C16H14BrN5O2 MolecularWeight: 388.21866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=CNNC2=N1)C3=C(C(=CC=C3)[N+](=O)[O-])Br)C#N

Isomeric SMILES

CCCC1=C(C(C2=CNNC2=N1)C3=C(C(=CC=C3)[N+](=O)[O-])Br)C#N

InChI

InChI=1S/C16H14BrN5O2/c1-2-4-12-10(7-18)14(11-8-19-21-16(11)20-12)9-5-3-6-13(15(9)17)22(23)24/h3,5-6,8,14H,2,4H2,1H3,(H2,19,20,21)