bis(8-methylnonyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate Openeye Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(8-methylnonyl) ester IUPAC Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(8-methylnonyl) ester Formula: C28H46O4 MolecularWeight: 446.66244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C

InChI

InChI=1S/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3