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

Systemtic Name: ethyl 6-(4-iodophenyl)-7-oxidanylidene-1-phenyl-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate Openeye Name: ethyl 6-(4-iodophenyl)-7-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate CAS Name: 6-(4-iodophenyl)-7-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-iodophenyl)-7-oxo-1-phenyl-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate Traditional Name: 6-(4-iodophenyl)-7-keto-1-phenyl-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid ethyl ester Formula: C21H18IN3O3 MolecularWeight: 487.29039

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18IN3O3/c1-2-28-21(27)18-17-12-13-24(15-10-8-14(22)9-11-15)20(26)19(17)25(23-18)16-6-4-3-5-7-16/h3-11H,2,12-13H2,1H3