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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H46O4/c1-21(2)14-10-8-12-18-31-26(29)24-17-16-23(28(5,6)7)20-25(24)27(30)32-19-13-9-11-15-22(3)4/h16-17,20-22H,8-15,18-19H2,1-7H3