O2-octyl O1-pentyl benzene-1,2-dicarboxylate

Systemtic Name: O2-octyl O1-pentyl benzene-1,2-dicarboxylate Openeye Name: O2-octyl O1-pentyl benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-octyl ester O1-pentyl ester IUPAC Name: 2-O-octyl 1-O-pentyl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-amyl ester O2-octyl ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC

InChI

InChI=1S/C21H32O4/c1-3-5-7-8-9-13-17-25-21(23)19-15-11-10-14-18(19)20(22)24-16-12-6-4-2/h10-11,14-15H,3-9,12-13,16-17H2,1-2H3