2,4-bis(2-tert-butylphenyl)benzene-1,3-dicarboxylate

Systemtic Name: 2,4-bis(2-tert-butylphenyl)benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(2-tert-butylphenyl)benzene-1,3-dicarboxylate CAS Name: 2,4-bis(2-tert-butylphenyl)benzene-1,3-dicarboxylate IUPAC Name: 2,4-bis(2-tert-butylphenyl)benzene-1,3-dicarboxylate Traditional Name: 2,4-bis(2-tert-butylphenyl)isophthalate Formula: C28H28O4-2 MolecularWeight: 428.51952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1C2=C(C(=C(C=C2)C(=O)[O-])C3=CC=CC=C3C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1C2=C(C(=C(C=C2)C(=O)[O-])C3=CC=CC=C3C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C28H30O4/c1-27(2,3)21-13-9-7-11-17(21)18-15-16-20(25(29)30)23(24(18)26(31)32)19-12-8-10-14-22(19)28(4,5)6/h7-16H,1-6H3,(H,29,30)(H,31,32)/p-2