3-bromanyl-5-methyl-2-pentyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 3-bromanyl-5-methyl-2-pentyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 3-bromo-5-methyl-2-pentyl-1,4-benzoquinone CAS Name: 3-bromo-5-methyl-2-pentylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 3-bromo-5-methyl-2-pentylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-amyl-3-bromo-5-methyl-p-benzoquinone Formula: C12H15BrO2 MolecularWeight: 271.1503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)C(=CC1=O)C)Br

Isomeric SMILES

CCCCCC1=C(C(=O)C(=CC1=O)C)Br

InChI

InChI=1S/C12H15BrO2/c1-3-4-5-6-9-10(14)7-8(2)12(15)11(9)13/h7H,3-6H2,1-2H3