6-methyl-5-(3-methylbutyl)-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione

Systemtic Name: 6-methyl-5-(3-methylbutyl)-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Openeye Name: 5-isopentyl-6-methyl-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione CAS Name: 6-methyl-5-(3-methylbutyl)-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione IUPAC Name: 6-methyl-5-(3-methylbutyl)-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-dione Traditional Name: 5-isoamyl-6-methyl-2-phenyl-1,7-dihydropyrazolo[3,4-b]pyridine-3,4-quinone Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)NN(C2=O)C3=CC=CC=C3)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)NN(C2=O)C3=CC=CC=C3)CCC(C)C

InChI

InChI=1S/C18H21N3O2/c1-11(2)9-10-14-12(3)19-17-15(16(14)22)18(23)21(20-17)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H2,19,20,22)