bis(6-methylheptyl) 3-ethylbenzene-1,2-dicarboxylate

Systemtic Name: bis(6-methylheptyl) 3-ethylbenzene-1,2-dicarboxylate Openeye Name: bis(6-methylheptyl) 3-ethylbenzene-1,2-dicarboxylate CAS Name: 3-ethylbenzene-1,2-dicarboxylic acid bis(6-methylheptyl) ester IUPAC Name: bis(6-methylheptyl) 3-ethylbenzene-1,2-dicarboxylate Traditional Name: 3-ethylbenzene-1,2-dicarboxylic acid bis(6-methylheptyl) ester Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

Isomeric SMILES

CCC1=CC=CC(=C1C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

InChI

InChI=1S/C26H42O4/c1-6-22-16-13-17-23(25(27)29-18-11-7-9-14-20(2)3)24(22)26(28)30-19-12-8-10-15-21(4)5/h13,16-17,20-21H,6-12,14-15,18-19H2,1-5H3