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

Systemtic Name: methyl 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: methyl 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NN(C2=N1)C)C3CCCCC3)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C)C3CCCCC3)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H26N4O4/c1-13-17(22(27)30-3)18(15-11-7-8-12-16(15)26(28)29)19-20(14-9-5-4-6-10-14)24-25(2)21(19)23-13/h7-8,11-12,14,18,24H,4-6,9-10H2,1-3H3