3,4-bis(2,6-dimethylphenyl)phthalate

Systemtic Name: 3,4-bis(2,6-dimethylphenyl)phthalate Openeye Name: 3,4-bis(2,6-dimethylphenyl)phthalate CAS Name: 3,4-bis(2,6-dimethylphenyl)phthalate IUPAC Name: 3,4-bis(2,6-dimethylphenyl)phthalate Traditional Name: 3,4-bis(2,6-dimethylphenyl)phthalate Formula: C24H20O4-2 MolecularWeight: 372.4132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=C(C(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=C(C=CC=C3C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=C(C(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=C(C=CC=C3C)C

InChI

InChI=1S/C24H22O4/c1-13-7-5-8-14(2)19(13)17-11-12-18(23(25)26)22(24(27)28)21(17)20-15(3)9-6-10-16(20)4/h5-12H,1-4H3,(H,25,26)(H,27,28)/p-2