1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate

Systemtic Name: 1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate Openeye Name: 1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate CAS Name: 1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate IUPAC Name: 1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate Traditional Name: 1,4,6-tripropyldibenzo-p-dioxin-2,3-diolate Formula: C21H24O4-2 MolecularWeight: 340.41286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC=C1)OC3=C(O2)C(=C(C(=C3CCC)[O-])[O-])CCC

Isomeric SMILES

CCCC1=C2C(=CC=C1)OC3=C(O2)C(=C(C(=C3CCC)[O-])[O-])CCC

InChI

InChI=1S/C21H26O4/c1-4-8-13-11-7-12-16-19(13)25-21-15(10-6-3)18(23)17(22)14(9-5-2)20(21)24-16/h7,11-12,22-23H,4-6,8-10H2,1-3H3/p-2