3-(9-ethylheptadecan-9-yloxy)benzene-1,2-diolate

Systemtic Name: 3-(9-ethylheptadecan-9-yloxy)benzene-1,2-diolate Openeye Name: 3-(1-ethyl-1-octyl-nonoxy)benzene-1,2-diolate CAS Name: 3-(9-ethylheptadecan-9-yloxy)benzene-1,2-diolate IUPAC Name: 3-(9-ethylheptadecan-9-yloxy)benzene-1,2-diolate Traditional Name: 3-(1-ethyl-1-octyl-nonoxy)benzene-1,2-diolate Formula: C25H42O3-2 MolecularWeight: 390.59918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC)(CCCCCCCC)OC1=CC=CC(=C1[O-])[O-]

Isomeric SMILES

CCCCCCCCC(CC)(CCCCCCCC)OC1=CC=CC(=C1[O-])[O-]

InChI

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