3-(1-decoxynonyl)benzene-1,2-diolate

Systemtic Name: 3-(1-decoxynonyl)benzene-1,2-diolate Openeye Name: 3-(1-decoxynonyl)benzene-1,2-diolate CAS Name: 3-(1-decoxynonyl)benzene-1,2-diolate IUPAC Name: 3-(1-decoxynonyl)benzene-1,2-diolate Traditional Name: 3-(1-decoxynonyl)benzene-1,2-diolate Formula: C25H42O3-2 MolecularWeight: 390.59918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(CCCCCCCC)C1=C(C(=CC=C1)[O-])[O-]

Isomeric SMILES

CCCCCCCCCCOC(CCCCCCCC)C1=C(C(=CC=C1)[O-])[O-]

InChI

InChI=1S/C25H44O3/c1-3-5-7-9-11-12-14-16-21-28-24(20-15-13-10-8-6-4-2)22-18-17-19-23(26)25(22)27/h17-19,24,26-27H,3-16,20-21H2,1-2H3/p-2