bis(1,1-dibutoxyethyl) benzene-1,3-dicarboxylate

Systemtic Name: bis(1,1-dibutoxyethyl) benzene-1,3-dicarboxylate Openeye Name: bis(1,1-dibutoxyethyl) benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis(1,1-dibutoxyethyl) ester IUPAC Name: bis(1,1-dibutoxyethyl) benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis(1,1-dibutoxyethyl) ester Formula: C28H46O8 MolecularWeight: 510.66004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)(OCCCC)OC(=O)C1=CC(=CC=C1)C(=O)OC(C)(OCCCC)OCCCC

Isomeric SMILES

CCCCOC(C)(OCCCC)OC(=O)C1=CC(=CC=C1)C(=O)OC(C)(OCCCC)OCCCC

InChI

InChI=1S/C28H46O8/c1-7-11-18-31-27(5,32-19-12-8-2)35-25(29)23-16-15-17-24(22-23)26(30)36-28(6,33-20-13-9-3)34-21-14-10-4/h15-17,22H,7-14,18-21H2,1-6H3