1-methyl-5-(5-oxidanylidenehexyl)-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione

Systemtic Name: 1-methyl-5-(5-oxidanylidenehexyl)-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione Openeye Name: 1-methyl-5-(5-oxohexyl)-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione CAS Name: 1-methyl-5-(5-oxohexyl)-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione IUPAC Name: 1-methyl-5-(5-oxohexyl)-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione Traditional Name: 5-(5-ketohexyl)-1-methyl-3-propyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-quinone Formula: C15H22N4O3 MolecularWeight: 306.36018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NC(=O)N(C2=O)CCCCC(=O)C)N(N1)C

Isomeric SMILES

CCCC1=C2C(=NC(=O)N(C2=O)CCCCC(=O)C)N(N1)C

InChI

InChI=1S/C15H22N4O3/c1-4-7-11-12-13(18(3)17-11)16-15(22)19(14(12)21)9-6-5-8-10(2)20/h17H,4-9H2,1-3H3