2-(3,3-dimethyl-2-oxidanylidene-butyl)-4-methyl-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)-4-methyl-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)-4-methyl-7-phenyl-purino[8,7-b]oxazole-1,3-dione CAS Name: 2-(3,3-dimethyl-2-oxobutyl)-4-methyl-7-phenylpurino[8,7-b]oxazole-1,3-dione IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)-4-methyl-7-phenylpurino[8,7-b][1,3]oxazole-1,3-dione Traditional Name: 2-(2-keto-3,3-dimethyl-butyl)-4-methyl-7-phenyl-purino[8,7-b]oxazole-1,3-quinone Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=O)C2=C(N=C3N2C=C(O3)C4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=O)C2=C(N=C3N2C=C(O3)C4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C20H20N4O4/c1-20(2,3)14(25)11-24-17(26)15-16(22(4)19(24)27)21-18-23(15)10-13(28-18)12-8-6-5-7-9-12/h5-10H,11H2,1-4H3