2,3,5,6-tetraheptoxybenzoate

Systemtic Name: 2,3,5,6-tetraheptoxybenzoate Openeye Name: 2,3,5,6-tetraheptoxybenzoate CAS Name: 2,3,5,6-tetraheptoxybenzoate IUPAC Name: 2,3,5,6-tetraheptoxybenzoate Traditional Name: 2,3,5,6-tetraheptoxybenzoate Formula: C35H61O6- MolecularWeight: 577.85524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=C(C(=C1OCCCCCCC)C(=O)[O-])OCCCCCCC)OCCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC(=C(C(=C1OCCCCCCC)C(=O)[O-])OCCCCCCC)OCCCCCCC

InChI

InChI=1S/C35H62O6/c1-5-9-13-17-21-25-38-30-29-31(39-26-22-18-14-10-6-2)34(41-28-24-20-16-12-8-4)32(35(36)37)33(30)40-27-23-19-15-11-7-3/h29H,5-28H2,1-4H3,(H,36,37)/p-1