diheptan-3-yl 5-(hydroxymethyl)benzene-1,3-dicarboxylate

Systemtic Name: diheptan-3-yl 5-(hydroxymethyl)benzene-1,3-dicarboxylate Openeye Name: bis(1-ethylpentyl) 5-(hydroxymethyl)benzene-1,3-dicarboxylate CAS Name: 5-(hydroxymethyl)benzene-1,3-dicarboxylic acid diheptan-3-yl ester IUPAC Name: diheptan-3-yl 5-(hydroxymethyl)benzene-1,3-dicarboxylate Traditional Name: 5-methylolbenzene-1,3-dicarboxylic acid bis(1-ethylpentyl) ester Formula: C23H36O5 MolecularWeight: 392.52894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)OC(=O)C1=CC(=CC(=C1)CO)C(=O)OC(CC)CCCC

Isomeric SMILES

CCCCC(CC)OC(=O)C1=CC(=CC(=C1)CO)C(=O)OC(CC)CCCC

InChI

InChI=1S/C23H36O5/c1-5-9-11-20(7-3)27-22(25)18-13-17(16-24)14-19(15-18)23(26)28-21(8-4)12-10-6-2/h13-15,20-21,24H,5-12,16H2,1-4H3