O1-dodecyl O2-pentan-2-yl benzene-1,2-dicarboxylate

Systemtic Name: O1-dodecyl O2-pentan-2-yl benzene-1,2-dicarboxylate Openeye Name: O1-dodecyl O2-(1-methylbutyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-dodecyl ester O2-pentan-2-yl ester IUPAC Name: 1-O-dodecyl 2-O-pentan-2-yl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-lauryl ester O2-(1-methylbutyl) ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H40O4/c1-4-6-7-8-9-10-11-12-13-16-20-28-24(26)22-18-14-15-19-23(22)25(27)29-21(3)17-5-2/h14-15,18-19,21H,4-13,16-17,20H2,1-3H3