3-tridecan-7-yloxybenzene-1,2-diolate

Systemtic Name: 3-tridecan-7-yloxybenzene-1,2-diolate Openeye Name: 3-(1-hexylheptoxy)benzene-1,2-diolate CAS Name: 3-tridecan-7-yloxybenzene-1,2-diolate IUPAC Name: 3-tridecan-7-yloxybenzene-1,2-diolate Traditional Name: 3-(1-hexylheptoxy)benzene-1,2-diolate Formula: C19H30O3-2 MolecularWeight: 306.4397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCC)OC1=CC=CC(=C1[O-])[O-]

Isomeric SMILES

CCCCCCC(CCCCCC)OC1=CC=CC(=C1[O-])[O-]

InChI

InChI=1S/C19H32O3/c1-3-5-7-9-12-16(13-10-8-6-4-2)22-18-15-11-14-17(20)19(18)21/h11,14-16,20-21H,3-10,12-13H2,1-2H3/p-2