2-bromanyl-3,7-dimethyl-6-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-3,7-dimethyl-6-oxidanyl-naphthalene-1,4-dione Openeye Name: 2-bromo-6-hydroxy-3,7-dimethyl-naphthalene-1,4-dione CAS Name: 2-bromo-6-hydroxy-3,7-dimethylnaphthalene-1,4-dione IUPAC Name: 2-bromo-6-hydroxy-3,7-dimethylnaphthalene-1,4-dione Traditional Name: 2-bromo-6-hydroxy-3,7-dimethyl-1,4-naphthoquinone Formula: C12H9BrO3 MolecularWeight: 281.10206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(C2=O)C)Br)O

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(C2=O)C)Br)O

InChI

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