1-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-nitro-pyrrole-2-carbonitrile

Systemtic Name: 1-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-nitro-pyrrole-2-carbonitrile Openeye Name: 1-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-nitro-pyrrole-2-carbonitrile CAS Name: 1-[4-[(2-butyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]-4-nitro-2-pyrrolecarbonitrile IUPAC Name: 1-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-nitropyrrole-2-carbonitrile Traditional Name: 1-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-nitro-pyrrole-2-carbonitrile Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)N4C=C(C=C4C#N)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)N4C=C(C=C4C#N)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C22H20N6O2/c1-2-3-6-21-25-20-5-4-11-24-22(20)27(21)14-16-7-9-17(10-8-16)26-15-19(28(29)30)12-18(26)13-23/h4-5,7-12,15H,2-3,6,14H2,1H3