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

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

CCCC1=C2C(C(=C(N=C2N(N1)C)C)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C2C(C(=C(N=C2N(N1)C)C)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O4/c1-4-6-13-16-15(11-7-5-8-12(9-11)22(25)26)14(18(23)24)10(2)19-17(16)21(3)20-13/h5,7-9,15,20H,4,6H2,1-3H3,(H,23,24)