1-[2-(4-chloranylphenoxy)ethanoyl]-4-(3,4-dimethoxyphenyl)-3-methyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 1-[2-(4-chloranylphenoxy)ethanoyl]-4-(3,4-dimethoxyphenyl)-3-methyl-6-oxidanylidene-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 1-[2-(4-chlorophenoxy)acetyl]-4-(3,4-dimethoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 1-[2-(4-chlorophenoxy)-1-oxoethyl]-4-(3,4-dimethoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 1-[2-(4-chlorophenoxy)acetyl]-4-(3,4-dimethoxyphenyl)-3-methyl-6-oxo-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 1-[2-(4-chlorophenoxy)acetyl]-4-(3,4-dimethoxyphenyl)-6-keto-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C24H21ClN4O5 MolecularWeight: 480.90034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(C(=O)N=C2N(N1)C(=O)COC3=CC=C(C=C3)Cl)C#N)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C2C(C(C(=O)N=C2N(N1)C(=O)COC3=CC=C(C=C3)Cl)C#N)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H21ClN4O5/c1-13-21-22(14-4-9-18(32-2)19(10-14)33-3)17(11-26)24(31)27-23(21)29(28-13)20(30)12-34-16-7-5-15(25)6-8-16/h4-10,17,22,28H,12H2,1-3H3