1,5,6,8-tetrakis(oxidanyl)-7-[(E)-3-oxidanylidenehex-1-enyl]naphthalene-2,3-dione

Systemtic Name: 1,5,6,8-tetrakis(oxidanyl)-7-[(E)-3-oxidanylidenehex-1-enyl]naphthalene-2,3-dione Openeye Name: 1,5,6,8-tetrahydroxy-7-[(E)-3-oxohex-1-enyl]naphthalene-2,3-dione CAS Name: 1,5,6,8-tetrahydroxy-7-[(E)-3-oxohex-1-enyl]naphthalene-2,3-dione IUPAC Name: 1,5,6,8-tetrahydroxy-7-[(E)-3-oxohex-1-enyl]naphthalene-2,3-dione Traditional Name: 1,5,6,8-tetrahydroxy-7-[(E)-3-ketohex-1-enyl]-2,3-naphthoquinone Formula: C16H14O7 MolecularWeight: 318.27816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C=CC1=C(C2=C(C(=O)C(=O)C=C2C(=C1O)O)O)O

Isomeric SMILES

CCCC(=O)/C=C/C1=C(C2=C(C(=O)C(=O)C=C2C(=C1O)O)O)O

InChI

InChI=1S/C16H14O7/c1-2-3-7(17)4-5-8-12(19)11-9(14(21)13(8)20)6-10(18)15(22)16(11)23/h4-6,19-21,23H,2-3H2,1H3/b5-4+