3-nonoxy-4,5,6-tripentyl-benzene-1,2-diolate

Systemtic Name: 3-nonoxy-4,5,6-tripentyl-benzene-1,2-diolate Openeye Name: 3-nonoxy-4,5,6-tripentyl-benzene-1,2-diolate CAS Name: 3-nonoxy-4,5,6-tripentylbenzene-1,2-diolate IUPAC Name: 3-nonoxy-4,5,6-tripentylbenzene-1,2-diolate Traditional Name: 3,4,5-triamyl-6-nonoxy-benzene-1,2-diolate Formula: C30H52O3-2 MolecularWeight: 460.73208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(C(=C(C(=C1[O-])[O-])CCCCC)CCCCC)CCCCC

Isomeric SMILES

CCCCCCCCCOC1=C(C(=C(C(=C1[O-])[O-])CCCCC)CCCCC)CCCCC

InChI

InChI=1S/C30H54O3/c1-5-9-13-14-15-16-20-24-33-30-27(23-19-12-8-4)25(21-17-10-6-2)26(22-18-11-7-3)28(31)29(30)32/h31-32H,5-24H2,1-4H3/p-2