3-tert-butyl-4-(2-methoxycarbonylphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 3-tert-butyl-4-(2-methoxycarbonylphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 3-tert-butyl-4-(2-methoxycarbonylphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 3-tert-butyl-4-(2-methoxycarbonylphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid IUPAC Name: 3-tert-butyl-4-(2-methoxycarbonylphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 3-tert-butyl-4-(2-carbomethoxyphenyl)-1,6-dimethyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NN(C2=N1)C)C(C)(C)C)C3=CC=CC=C3C(=O)OC)C(=O)O

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C)C(C)(C)C)C3=CC=CC=C3C(=O)OC)C(=O)O

InChI

InChI=1S/C21H25N3O4/c1-11-14(19(25)26)15(12-9-7-8-10-13(12)20(27)28-6)16-17(21(2,3)4)23-24(5)18(16)22-11/h7-10,15,23H,1-6H3,(H,25,26)