O1-butyl O2-tridecyl benzene-1,2-dicarboxylate

Systemtic Name: O1-butyl O2-tridecyl benzene-1,2-dicarboxylate Openeye Name: O1-butyl O2-tridecyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-butyl ester O2-tridecyl ester IUPAC Name: 1-O-butyl 2-O-tridecyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-butyl ester O2-tridecyl ester Formula: C25H40O4 MolecularWeight: 404.5827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC

InChI

InChI=1S/C25H40O4/c1-3-5-7-8-9-10-11-12-13-14-17-21-29-25(27)23-19-16-15-18-22(23)24(26)28-20-6-4-2/h15-16,18-19H,3-14,17,20-21H2,1-2H3