methoxymethane; 5-oxidanylnaphthalene-1,4-dione

Systemtic Name: methoxymethane; 5-oxidanylnaphthalene-1,4-dione Openeye Name: 5-hydroxynaphthalene-1,4-dione; methoxymethane CAS Name: 5-hydroxynaphthalene-1,4-dione; methoxymethane IUPAC Name: 5-hydroxynaphthalene-1,4-dione; methoxymethane Traditional Name: juglone; methoxymethane Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

COC.C1=CC2=C(C(=O)C=CC2=O)C(=C1)O

Isomeric SMILES

COC.C1=CC2=C(C(=O)C=CC2=O)C(=C1)O

InChI

InChI=1S/C10H6O3.C2H6O/c11-7-4-5-9(13)10-6(7)2-1-3-8(10)12;1-3-2/h1-5,12H;1-2H3