O1-dodecyl O2-octan-4-yl benzene-1,2-dicarboxylate

Systemtic Name: O1-dodecyl O2-octan-4-yl benzene-1,2-dicarboxylate Openeye Name: O1-dodecyl O2-(1-propylpentyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-dodecyl ester O2-octan-4-yl ester IUPAC Name: 1-O-dodecyl 2-O-octan-4-yl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-lauryl ester O2-(1-propylpentyl) ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC(CCC)CCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC(CCC)CCCC

InChI

InChI=1S/C28H46O4/c1-4-7-9-10-11-12-13-14-15-18-23-31-27(29)25-21-16-17-22-26(25)28(30)32-24(19-6-3)20-8-5-2/h16-17,21-22,24H,4-15,18-20,23H2,1-3H3