2-bromanyl-3-methoxy-6-methyl-5-pentyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-bromanyl-3-methoxy-6-methyl-5-pentyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-bromo-3-methoxy-6-methyl-5-pentyl-1,4-benzoquinone CAS Name: 2-bromo-3-methoxy-6-methyl-5-pentylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-bromo-3-methoxy-6-methyl-5-pentylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-amyl-5-bromo-6-methoxy-3-methyl-p-benzoquinone Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)C(=C(C1=O)OC)Br)C

Isomeric SMILES

CCCCCC1=C(C(=O)C(=C(C1=O)OC)Br)C

InChI

InChI=1S/C13H17BrO3/c1-4-5-6-7-9-8(2)11(15)10(14)13(17-3)12(9)16/h4-7H2,1-3H3