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

Systemtic Name: 6-azanyl-1-(3,4-dimethylphenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Openeye Name: 6-amino-1-(3,4-dimethylphenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile CAS Name: 6-amino-1-(3,4-dimethylphenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile IUPAC Name: 6-amino-1-(3,4-dimethylphenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Traditional Name: 6-amino-1-(3,4-dimethylphenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-1-ium-5-carbonitrile Formula: C25H26N5O3+ MolecularWeight: 444.50564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+]2=C3C(=C(N2)C)C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+]2=C3C(=C(N2)C)C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C

InChI

InChI=1S/C25H25N5O3/c1-13-7-8-17(9-14(13)2)30-25-21(15(3)29-30)22(18(12-26)24(27)28-25)16-10-19(31-4)23(33-6)20(11-16)32-5/h7-11H,1-6H3,(H2,27,28,29)/p+1