bis(2-methylpentyl) 5-methylbenzene-1,3-dicarboxylate

Systemtic Name: bis(2-methylpentyl) 5-methylbenzene-1,3-dicarboxylate Openeye Name: bis(2-methylpentyl) 5-methylbenzene-1,3-dicarboxylate CAS Name: 5-methylbenzene-1,3-dicarboxylic acid bis(2-methylpentyl) ester IUPAC Name: bis(2-methylpentyl) 5-methylbenzene-1,3-dicarboxylate Traditional Name: 5-methylbenzene-1,3-dicarboxylic acid bis(2-methylpentyl) ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COC(=O)C1=CC(=CC(=C1)C)C(=O)OCC(C)CCC

Isomeric SMILES

CCCC(C)COC(=O)C1=CC(=CC(=C1)C)C(=O)OCC(C)CCC

InChI

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