2-bromanyl-7-ethyl-6-methoxy-8-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-7-ethyl-6-methoxy-8-oxidanyl-naphthalene-1,4-dione Openeye Name: 2-bromo-7-ethyl-8-hydroxy-6-methoxy-naphthalene-1,4-dione CAS Name: 2-bromo-7-ethyl-8-hydroxy-6-methoxynaphthalene-1,4-dione IUPAC Name: 2-bromo-7-ethyl-8-hydroxy-6-methoxynaphthalene-1,4-dione Traditional Name: 2-bromo-7-ethyl-8-hydroxy-6-methoxy-1,4-naphthoquinone Formula: C13H11BrO4 MolecularWeight: 311.12804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=O)C=C(C(=O)C2=C1O)Br)OC

Isomeric SMILES

CCC1=C(C=C2C(=O)C=C(C(=O)C2=C1O)Br)OC

InChI

InChI=1S/C13H11BrO4/c1-3-6-10(18-2)4-7-9(15)5-8(14)13(17)11(7)12(6)16/h4-5,16H,3H2,1-2H3