3,4-bis(5-methyl-2-propan-2-yl-phenyl)phthalate

Systemtic Name: 3,4-bis(5-methyl-2-propan-2-yl-phenyl)phthalate Openeye Name: 3,4-bis(2-isopropyl-5-methyl-phenyl)phthalate CAS Name: 3,4-bis(5-methyl-2-propan-2-ylphenyl)phthalate IUPAC Name: 3,4-bis(5-methyl-2-propan-2-ylphenyl)phthalate Traditional Name: 3,4-bis(2-isopropyl-5-methyl-phenyl)phthalate Formula: C28H28O4-2 MolecularWeight: 428.51952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)C2=C(C(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=C(C=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)C2=C(C(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=C(C=CC(=C3)C)C(C)C

InChI

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