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

Systemtic Name: 3-(1,1-dibutoxyoctyl)benzene-1,2-diolate Openeye Name: 3-(1,1-dibutoxyoctyl)benzene-1,2-diolate CAS Name: 3-(1,1-dibutoxyoctyl)benzene-1,2-diolate IUPAC Name: 3-(1,1-dibutoxyoctyl)benzene-1,2-diolate Traditional Name: 3-(1,1-dibutoxyoctyl)benzene-1,2-diolate Formula: C22H36O4-2 MolecularWeight: 364.51884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38O4/c1-4-7-10-11-12-16-22(25-17-8-5-2,26-18-9-6-3)19-14-13-15-20(23)21(19)24/h13-15,23-24H,4-12,16-18H2,1-3H3/p-2