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

Systemtic Name: 3-methoxy-5,6,8-tris(oxidanyl)-7-[(E)-3-oxidanylidenehex-1-enyl]naphthalene-1,2-dione Openeye Name: 5,6,8-trihydroxy-3-methoxy-7-[(E)-3-oxohex-1-enyl]naphthalene-1,2-dione CAS Name: 5,6,8-trihydroxy-3-methoxy-7-[(E)-3-oxohex-1-enyl]naphthalene-1,2-dione IUPAC Name: 5,6,8-trihydroxy-3-methoxy-7-[(E)-3-oxohex-1-enyl]naphthalene-1,2-dione Traditional Name: 5,6,8-trihydroxy-7-[(E)-3-ketohex-1-enyl]-3-methoxy-1,2-naphthoquinone Formula: C17H16O7 MolecularWeight: 332.30474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O7/c1-3-4-8(18)5-6-9-13(19)12-10(15(21)14(9)20)7-11(24-2)16(22)17(12)23/h5-7,19-21H,3-4H2,1-2H3/b6-5+