3-butanoyl-4,5,7-tris(oxidanyl)naphthalene-1,2-dione

Systemtic Name: 3-butanoyl-4,5,7-tris(oxidanyl)naphthalene-1,2-dione Openeye Name: 3-butanoyl-4,5,7-trihydroxy-naphthalene-1,2-dione CAS Name: 4,5,7-trihydroxy-3-(1-oxobutyl)naphthalene-1,2-dione IUPAC Name: 3-butanoyl-4,5,7-trihydroxynaphthalene-1,2-dione Traditional Name: 3-butyryl-4,5,7-trihydroxy-1,2-naphthoquinone Formula: C14H12O6 MolecularWeight: 276.24148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C2=C(C=C(C=C2C(=O)C1=O)O)O)O

Isomeric SMILES

CCCC(=O)C1=C(C2=C(C=C(C=C2C(=O)C1=O)O)O)O

InChI

InChI=1S/C14H12O6/c1-2-3-8(16)11-13(19)10-7(12(18)14(11)20)4-6(15)5-9(10)17/h4-5,15,17,19H,2-3H2,1H3