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

Systemtic Name: O1-nonyl O2-octan-4-yl benzene-1,2-dicarboxylate Openeye Name: O1-nonyl O2-(1-propylpentyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-nonyl ester O2-octan-4-yl ester IUPAC Name: 1-O-nonyl 2-O-octan-4-yl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-nonyl ester O2-(1-propylpentyl) ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H40O4/c1-4-7-9-10-11-12-15-20-28-24(26)22-18-13-14-19-23(22)25(27)29-21(16-6-3)17-8-5-2/h13-14,18-19,21H,4-12,15-17,20H2,1-3H3