bis(6-methylheptyl) 4-butylbenzene-1,2-dicarboxylate

Systemtic Name: bis(6-methylheptyl) 4-butylbenzene-1,2-dicarboxylate Openeye Name: bis(6-methylheptyl) 4-butylbenzene-1,2-dicarboxylate CAS Name: 4-butylbenzene-1,2-dicarboxylic acid bis(6-methylheptyl) ester IUPAC Name: bis(6-methylheptyl) 4-butylbenzene-1,2-dicarboxylate Traditional Name: 4-butylbenzene-1,2-dicarboxylic acid bis(6-methylheptyl) ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C(=O)OCCCCCC(C)C)C(=O)OCCCCCC(C)C

InChI

InChI=1S/C28H46O4/c1-6-7-16-24-17-18-25(27(29)31-19-12-8-10-14-22(2)3)26(21-24)28(30)32-20-13-9-11-15-23(4)5/h17-18,21-23H,6-16,19-20H2,1-5H3