3-(8-methylpentadecan-8-yloxy)benzene-1,2-diolate

Systemtic Name: 3-(8-methylpentadecan-8-yloxy)benzene-1,2-diolate Openeye Name: 3-(1-heptyl-1-methyl-octoxy)benzene-1,2-diolate CAS Name: 3-(8-methylpentadecan-8-yloxy)benzene-1,2-diolate IUPAC Name: 3-(8-methylpentadecan-8-yloxy)benzene-1,2-diolate Traditional Name: 3-(1-heptyl-1-methyl-octoxy)benzene-1,2-diolate Formula: C22H36O3-2 MolecularWeight: 348.51944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)(CCCCCCC)OC1=CC=CC(=C1[O-])[O-]

Isomeric SMILES

CCCCCCCC(C)(CCCCCCC)OC1=CC=CC(=C1[O-])[O-]

InChI

InChI=1S/C22H38O3/c1-4-6-8-10-12-17-22(3,18-13-11-9-7-5-2)25-20-16-14-15-19(23)21(20)24/h14-16,23-24H,4-13,17-18H2,1-3H3/p-2