3,4,5-tributoxy-6-octyl-benzene-1,2-diolate

Systemtic Name: 3,4,5-tributoxy-6-octyl-benzene-1,2-diolate Openeye Name: 3,4,5-tributoxy-6-octyl-benzene-1,2-diolate CAS Name: 3,4,5-tributoxy-6-octylbenzene-1,2-diolate IUPAC Name: 3,4,5-tributoxy-6-octylbenzene-1,2-diolate Traditional Name: 3,4,5-tributoxy-6-octyl-benzene-1,2-diolate Formula: C26H44O5-2 MolecularWeight: 436.62456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C(=C1OCCCC)OCCCC)OCCCC)[O-])[O-]

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C(=C1OCCCC)OCCCC)OCCCC)[O-])[O-]

InChI

InChI=1S/C26H46O5/c1-5-9-13-14-15-16-17-21-22(27)23(28)25(30-19-11-7-3)26(31-20-12-8-4)24(21)29-18-10-6-2/h27-28H,5-20H2,1-4H3/p-2