3-bromanyl-5-oxidanyl-2-prop-2-enyl-naphthalene-1,4-dione

Systemtic Name: 3-bromanyl-5-oxidanyl-2-prop-2-enyl-naphthalene-1,4-dione Openeye Name: 2-allyl-3-bromo-5-hydroxy-naphthalene-1,4-dione CAS Name: 3-bromo-5-hydroxy-2-prop-2-enylnaphthalene-1,4-dione IUPAC Name: 3-bromo-5-hydroxy-2-prop-2-enylnaphthalene-1,4-dione Traditional Name: 2-allyl-3-bromo-5-hydroxy-1,4-naphthoquinone Formula: C13H9BrO3 MolecularWeight: 293.11276

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C(=O)C2=C(C1=O)C=CC=C2O)Br

Isomeric SMILES

C=CCC1=C(C(=O)C2=C(C1=O)C=CC=C2O)Br

InChI

InChI=1S/C13H9BrO3/c1-2-4-8-11(14)13(17)10-7(12(8)16)5-3-6-9(10)15/h2-3,5-6,15H,1,4H2