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bis(6-methylheptyl) 3-tert-butylbenzene-1,2-dicarboxylate

bis(6-methylheptyl) 3-tert-butylbenzene-1,2-dicarboxylate

Systemtic Name:bis(6-methylheptyl) 3-tert-butylbenzene-1,2-dicarboxylate
Openeye Name:bis(6-methylheptyl) 3-tert-butylbenzene-1,2-dicarboxylate
CAS Name:3-tert-butylbenzene-1,2-dicarboxylic acid bis(6-methylheptyl) ester
IUPAC Name:bis(6-methylheptyl) 3-tert-butylbenzene-1,2-dicarboxylate
Traditional Name:3-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(=CC=C1)C(C)(C)C)C(=O)OCCCCCC(C)C


Isomeric SMILES

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


InChI

InChI=1S/C28H46O4/c1-21(2)15-10-8-12-19-31-26(29)23-17-14-18-24(28(5,6)7)25(23)27(30)32-20-13-9-11-16-22(3)4/h14,17-18,21-22H,8-13,15-16,19-20H2,1-7H3


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