dodecylbenzene; hydrogen sulfite; iron(3+)

Systemtic Name: dodecylbenzene; hydrogen sulfite; iron(3+) Openeye Name: ferric; dodecylbenzene; hydrogen sulfite CAS Name: dodecylbenzene; hydrogen sulfite; iron(3+) IUPAC Name: dodecylbenzene; hydrogen sulfite; iron(3+) Traditional Name: ferric laurylbenzene tribisulfite Formula: C18H33FeO9S3 MolecularWeight: 545.48922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1.OS(=O)[O-].OS(=O)[O-].OS(=O)[O-].[Fe+3]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1.OS(=O)[O-].OS(=O)[O-].OS(=O)[O-].[Fe+3]

InChI

InChI=1S/C18H30.Fe.3H2O3S/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18;;3*1-4(2)3/h11,13-14,16-17H,2-10,12,15H2,1H3;;3*(H2,1,2,3)/q;+3;;;/p-3