bis(7-methyloctyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(7-methyloctyl) benzene-1,2-dicarboxylate Openeye Name: bis(7-methyloctyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(7-methyloctyl) ester IUPAC Name: bis(7-methyloctyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(7-methyloctyl) ester Formula: C26H42O4 MolecularWeight: 418.60928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC(C)C

InChI

InChI=1S/C26H42O4/c1-21(2)15-9-5-7-13-19-29-25(27)23-17-11-12-18-24(23)26(28)30-20-14-8-6-10-16-22(3)4/h11-12,17-18,21-22H,5-10,13-16,19-20H2,1-4H3