3,4,5,6-tetraoctylbenzene-1,2-diolate

Systemtic Name: 3,4,5,6-tetraoctylbenzene-1,2-diolate Openeye Name: 3,4,5,6-tetraoctylbenzene-1,2-diolate CAS Name: 3,4,5,6-tetraoctylbenzene-1,2-diolate IUPAC Name: 3,4,5,6-tetraoctylbenzene-1,2-diolate Traditional Name: 3,4,5,6-tetraoctylbenzene-1,2-diolate Formula: C38H68O2-2 MolecularWeight: 556.94532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C(=C1CCCCCCCC)[O-])[O-])CCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C(=C1CCCCCCCC)[O-])[O-])CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C38H70O2/c1-5-9-13-17-21-25-29-33-34(30-26-22-18-14-10-6-2)36(32-28-24-20-16-12-8-4)38(40)37(39)35(33)31-27-23-19-15-11-7-3/h39-40H,5-32H2,1-4H3/p-2