3-butoxy-4,5-didecyl-benzene-1,2-diolate

Systemtic Name: 3-butoxy-4,5-didecyl-benzene-1,2-diolate Openeye Name: 3-butoxy-4,5-didecyl-benzene-1,2-diolate CAS Name: 3-butoxy-4,5-didecylbenzene-1,2-diolate IUPAC Name: 3-butoxy-4,5-didecylbenzene-1,2-diolate Traditional Name: 3-butoxy-4,5-didecyl-benzene-1,2-diolate Formula: C30H52O3-2 MolecularWeight: 460.73208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C(=C1CCCCCCCCCC)OCCCC)[O-])[O-]

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C(=C1CCCCCCCCCC)OCCCC)[O-])[O-]

InChI

InChI=1S/C30H54O3/c1-4-7-10-12-14-16-18-20-22-26-25-28(31)29(32)30(33-24-9-6-3)27(26)23-21-19-17-15-13-11-8-5-2/h25,31-32H,4-24H2,1-3H3/p-2