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

Systemtic Name: 1,6-dimethyl-4-(2-nitrophenyl)-3-propan-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 3-isopropyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 1,6-dimethyl-4-(2-nitrophenyl)-3-propan-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid IUPAC Name: 1,6-dimethyl-4-(2-nitrophenyl)-3-propan-2-yl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 3-isopropyl-1,6-dimethyl-4-(2-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NN(C2=N1)C)C(C)C)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C)C(C)C)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C18H20N4O4/c1-9(2)16-15-14(11-7-5-6-8-12(11)22(25)26)13(18(23)24)10(3)19-17(15)21(4)20-16/h5-9,14,20H,1-4H3,(H,23,24)