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

Systemtic Name: 5-bromanyl-2-methoxy-3-methyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-bromo-2-methoxy-3-methyl-1,4-benzoquinone CAS Name: 5-bromo-2-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-bromo-2-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione Traditional Name: 5-bromo-2-methoxy-3-methyl-p-benzoquinone Formula: C8H7BrO3 MolecularWeight: 231.04338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C(C1=O)Br)OC

Isomeric SMILES

CC1=C(C(=O)C=C(C1=O)Br)OC

InChI

InChI=1S/C8H7BrO3/c1-4-7(11)5(9)3-6(10)8(4)12-2/h3H,1-2H3