bis(5-methylhexyl) benzene-1,3-dicarboxylate

Systemtic Name: bis(5-methylhexyl) benzene-1,3-dicarboxylate Openeye Name: bis(5-methylhexyl) benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis(5-methylhexyl) ester IUPAC Name: bis(5-methylhexyl) benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid bis(5-methylhexyl) ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCCC(C)C

Isomeric SMILES

CC(C)CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCCC(C)C

InChI

InChI=1S/C22H34O4/c1-17(2)10-5-7-14-25-21(23)19-12-9-13-20(16-19)22(24)26-15-8-6-11-18(3)4/h9,12-13,16-18H,5-8,10-11,14-15H2,1-4H3