2-bromanyl-5-methoxy-7-methyl-naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-5-methoxy-7-methyl-naphthalene-1,4-dione Openeye Name: 2-bromo-5-methoxy-7-methyl-naphthalene-1,4-dione CAS Name: 2-bromo-5-methoxy-7-methylnaphthalene-1,4-dione IUPAC Name: 2-bromo-5-methoxy-7-methylnaphthalene-1,4-dione Traditional Name: 2-bromo-5-methoxy-7-methyl-1,4-naphthoquinone Formula: C12H9BrO3 MolecularWeight: 281.10206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=CC2=O)Br)OC

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=CC2=O)Br)OC

InChI

InChI=1S/C12H9BrO3/c1-6-3-7-11(10(4-6)16-2)9(14)5-8(13)12(7)15/h3-5H,1-2H3