4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-b]pyridin-3-one Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C=CN=C3N2)C4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C=CN=C3N2)C4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C21H17N3O3/c1-12-3-5-15(9-13(12)2)24-21(25)19-16(7-8-22-20(19)23-24)14-4-6-17-18(10-14)27-11-26-17/h3-10H,11H2,1-2H3,(H,22,23)