(2-azanyl-2-oxidanylidene-ethyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1,6-diphenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-methyl-1,6-diphenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C22H18N4O3 MolecularWeight: 386.40332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OCC(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-14-20-17(22(28)29-13-19(23)27)12-18(15-8-4-2-5-9-15)24-21(20)26(25-14)16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H2,23,27)