3,4,5-tris-decyl-6-propoxy-benzene-1,2-diolate

Systemtic Name: 3,4,5-tris-decyl-6-propoxy-benzene-1,2-diolate Openeye Name: 3,4,5-tris-decyl-6-propoxy-benzene-1,2-diolate CAS Name: 3,4,5-tris-decyl-6-propoxybenzene-1,2-diolate IUPAC Name: 3,4,5-tris-decyl-6-propoxybenzene-1,2-diolate Traditional Name: 3,4,5-tris-decyl-6-propoxy-benzene-1,2-diolate Formula: C39H70O3-2 MolecularWeight: 586.9713

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCCC)OCCC)[O-])[O-])CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCCC)OCCC)[O-])[O-])CCCCCCCCCC

InChI

InChI=1S/C39H72O3/c1-5-9-12-15-18-21-24-27-30-34-35(31-28-25-22-19-16-13-10-6-2)37(40)38(41)39(42-33-8-4)36(34)32-29-26-23-20-17-14-11-7-3/h40-41H,5-33H2,1-4H3/p-2