ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxidanylidene-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate

Systemtic Name: ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxidanylidene-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate Openeye Name: ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate CAS Name: 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate Traditional Name: 6-(4-iodophenyl)-7-keto-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester Formula: C22H20IN3O4 MolecularWeight: 517.31637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CCN(C2=O)C3=CC=C(C=C3)I)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CCN(C2=O)C3=CC=C(C=C3)I)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20IN3O4/c1-3-30-22(28)19-18-12-13-25(15-6-4-14(23)5-7-15)21(27)20(18)26(24-19)16-8-10-17(29-2)11-9-16/h4-11H,3,12-13H2,1-2H3