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

Systemtic Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid IUPAC Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O4/c1-12-16(21(26)27)17(14-10-6-7-11-15(14)25(28)29)18-19(13-8-4-3-5-9-13)23-24(2)20(18)22-12/h6-7,10-11,13,17,23H,3-5,8-9H2,1-2H3,(H,26,27)