bis(3,7-dimethyloctyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(3,7-dimethyloctyl) benzene-1,2-dicarboxylate Openeye Name: bis(3,7-dimethyloctyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(3,7-dimethyloctyl) ester IUPAC Name: bis(3,7-dimethyloctyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(3,7-dimethyloctyl) ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)CCCC(C)C

Isomeric SMILES

CC(C)CCCC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)CCCC(C)C

InChI

InChI=1S/C28H46O4/c1-21(2)11-9-13-23(5)17-19-31-27(29)25-15-7-8-16-26(25)28(30)32-20-18-24(6)14-10-12-22(3)4/h7-8,15-16,21-24H,9-14,17-20H2,1-6H3