1-(2-methylpropyl)-7,8,9,10-tetrahydro-6H-purino[7,8-a]azepine-2,4-dione

Systemtic Name: 1-(2-methylpropyl)-7,8,9,10-tetrahydro-6H-purino[7,8-a]azepine-2,4-dione Openeye Name: 1-isobutyl-7,8,9,10-tetrahydro-6H-purino[7,8-a]azepine-2,4-dione CAS Name: 1-(2-methylpropyl)-7,8,9,10-tetrahydro-6H-purino[7,8-a]azepine-2,4-dione IUPAC Name: 1-(2-methylpropyl)-7,8,9,10-tetrahydro-6H-purino[7,8-a]azepine-2,4-dione Traditional Name: 1-isobutyl-7,8,9,10-tetrahydro-6H-purin[7,8-a]azepine-2,4-quinone Formula: C14H20N4O2 MolecularWeight: 276.3342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)NC1=O)N3CCCCCC3=N2

Isomeric SMILES

CC(C)CN1C2=C(C(=O)NC1=O)N3CCCCCC3=N2

InChI

InChI=1S/C14H20N4O2/c1-9(2)8-18-12-11(13(19)16-14(18)20)17-7-5-3-4-6-10(17)15-12/h9H,3-8H2,1-2H3,(H,16,19,20)