6-butyl-5-methyl-1-benzofuran-4,7-dione

Systemtic Name: 6-butyl-5-methyl-1-benzofuran-4,7-dione Openeye Name: 6-butyl-5-methyl-benzofuran-4,7-dione CAS Name: 6-butyl-5-methylbenzofuran-4,7-dione IUPAC Name: 6-butyl-5-methyl-1-benzofuran-4,7-dione Traditional Name: 6-butyl-5-methyl-benzofuran-4,7-quinone Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C2=C(C1=O)OC=C2)C

Isomeric SMILES

CCCCC1=C(C(=O)C2=C(C1=O)OC=C2)C

InChI

InChI=1S/C13H14O3/c1-3-4-5-9-8(2)11(14)10-6-7-16-13(10)12(9)15/h6-7H,3-5H2,1-2H3