methyl 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: methyl 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: methyl 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dicyclopentyl-6-methyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NN(C2=N1)C3CCCC3)C4CCCC4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C3CCCC3)C4CCCC4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C25H30N4O4/c1-15-20(25(30)33-2)21(17-10-7-13-19(14-17)29(31)32)22-23(16-8-3-4-9-16)27-28(24(22)26-15)18-11-5-6-12-18/h7,10,13-14,16,18,21,27H,3-6,8-9,11-12H2,1-2H3