bis(2-ethynylhexyl) benzene-1,2-dicarboxylate

Systemtic Name: bis(2-ethynylhexyl) benzene-1,2-dicarboxylate Openeye Name: bis(2-ethynylhexyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid bis(2-ethynylhexyl) ester IUPAC Name: bis(2-ethynylhexyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid bis(2-butylbut-3-ynyl) ester Formula: C24H30O4 MolecularWeight: 382.4926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(COC(=O)C1=CC=CC=C1C(=O)OCC(CCCC)C#C)C#C

Isomeric SMILES

CCCCC(COC(=O)C1=CC=CC=C1C(=O)OCC(CCCC)C#C)C#C

InChI

InChI=1S/C24H30O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h3-4,11-12,15-16,19-20H,5-6,9-10,13-14,17-18H2,1-2H3