6-chloranyl-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate

Systemtic Name: 6-chloranyl-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate Openeye Name: 6-chloro-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate CAS Name: 6-chloro-1,4-diethyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 6-chloro-1,4-diethyldibenzo-p-dioxin-2,3-diolate Traditional Name: 6-chloro-1,4-diethyl-dibenzo-p-dioxin-2,3-diolate Formula: C16H13ClO4-2 MolecularWeight: 304.72502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C2=C1OC3=C(O2)C(=CC=C3)Cl)CC)[O-])[O-]

Isomeric SMILES

CCC1=C(C(=C(C2=C1OC3=C(O2)C(=CC=C3)Cl)CC)[O-])[O-]

InChI

InChI=1S/C16H15ClO4/c1-3-8-12(18)13(19)9(4-2)15-14(8)20-11-7-5-6-10(17)16(11)21-15/h5-7,18-19H,3-4H2,1-2H3/p-2