O1-butyl O4-[(E)-docos-13-enyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-butyl O4-[(E)-docos-13-enyl] benzene-1,4-dicarboxylate Openeye Name: O1-butyl O4-[(E)-docos-13-enyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-[(E)-docos-13-enyl] ester IUPAC Name: 1-O-butyl 4-O-[(E)-docos-13-enyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O1-butyl ester O4-[(E)-docos-13-enyl] ester Formula: C34H56O4 MolecularWeight: 528.80604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC

InChI

InChI=1S/C34H56O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-30-38-34(36)32-27-25-31(26-28-32)33(35)37-29-6-4-2/h12-13,25-28H,3-11,14-24,29-30H2,1-2H3/b13-12+