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

Systemtic Name: (4-methyl-2-propan-2-yl-cyclohexyl) 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (2-isopropyl-4-methyl-cyclohexyl) 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid (4-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (4-methyl-2-propan-2-ylcyclohexyl) 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid (2-isopropyl-4-methyl-cyclohexyl) ester Formula: C30H40N4O4 MolecularWeight: 520.663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(C)C)OC(=O)C2=C(N=C3C(=C(NN3C)C4CCCC4)C2C5=CC(=CC=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1CCC(C(C1)C(C)C)OC(=O)C2=C(N=C3C(=C(NN3C)C4CCCC4)C2C5=CC(=CC=C5)[N+](=O)[O-])C

InChI

InChI=1S/C30H40N4O4/c1-17(2)23-15-18(3)13-14-24(23)38-30(35)25-19(4)31-29-27(28(32-33(29)5)20-9-6-7-10-20)26(25)21-11-8-12-22(16-21)34(36)37/h8,11-12,16-18,20,23-24,26,32H,6-7,9-10,13-15H2,1-5H3