diundecan-6-yl benzene-1,4-dicarboxylate

Systemtic Name: diundecan-6-yl benzene-1,4-dicarboxylate Openeye Name: bis(1-pentylhexyl) benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid diundecan-6-yl ester IUPAC Name: diundecan-6-yl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis(1-amylhexyl) ester Formula: C30H50O4 MolecularWeight: 474.7156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCCC)OC(=O)C1=CC=C(C=C1)C(=O)OC(CCCCC)CCCCC

Isomeric SMILES

CCCCCC(CCCCC)OC(=O)C1=CC=C(C=C1)C(=O)OC(CCCCC)CCCCC

InChI

InChI=1S/C30H50O4/c1-5-9-13-17-27(18-14-10-6-2)33-29(31)25-21-23-26(24-22-25)30(32)34-28(19-15-11-7-3)20-16-12-8-4/h21-24,27-28H,5-20H2,1-4H3