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

Systemtic Name: 2-phenoxyethyl 3-cyclohexyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: 2-phenoxyethyl 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 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 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 2-phenoxyethyl ester Formula: C29H32N4O5 MolecularWeight: 516.58818

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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)OCCOC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C)C3CCCCC3)C4=CC=CC=C4[N+](=O)[O-])C(=O)OCCOC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O5/c1-19-24(29(34)38-18-17-37-21-13-7-4-8-14-21)25(22-15-9-10-16-23(22)33(35)36)26-27(20-11-5-3-6-12-20)31-32(2)28(26)30-19/h4,7-10,13-16,20,25,31H,3,5-6,11-12,17-18H2,1-2H3