1,6,7,8,9-pentakis(chloranyl)-4-propyl-dibenzo-p-dioxin-2,3-diolate

Systemtic Name: 1,6,7,8,9-pentakis(chloranyl)-4-propyl-dibenzo-p-dioxin-2,3-diolate Openeye Name: 1,6,7,8,9-pentachloro-4-propyl-dibenzo-p-dioxin-2,3-diolate CAS Name: 1,6,7,8,9-pentachloro-4-propyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 1,6,7,8,9-pentachloro-4-propyldibenzo-p-dioxin-2,3-diolate Traditional Name: 1,6,7,8,9-pentachloro-4-propyl-dibenzo-p-dioxin-2,3-diolate Formula: C15H7Cl5O4-2 MolecularWeight: 428.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl)Cl)[O-])[O-]

Isomeric SMILES

CCCC1=C(C(=C(C2=C1OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl)Cl)[O-])[O-]

InChI

InChI=1S/C15H9Cl5O4/c1-2-3-4-10(21)11(22)9(20)15-12(4)23-13-7(18)5(16)6(17)8(19)14(13)24-15/h21-22H,2-3H2,1H3/p-2