4,6-bis[(2,3,4,5-tetramethylphenyl)methyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-bis[(2,3,4,5-tetramethylphenyl)methyl]benzene-1,3-dicarboxylic acid Openeye Name: 4,6-bis[(2,3,4,5-tetramethylphenyl)methyl]benzene-1,3-dicarboxylic acid CAS Name: 4,6-bis[(2,3,4,5-tetramethylphenyl)methyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4,6-bis[(2,3,4,5-tetramethylphenyl)methyl]benzene-1,3-dicarboxylic acid Traditional Name: 4,6-bis(2,3,4,5-tetramethylbenzyl)isophthalic acid Formula: C30H34O4 MolecularWeight: 458.58856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C)C)CC2=CC(=C(C=C2C(=O)O)C(=O)O)CC3=C(C(=C(C(=C3)C)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C)C)CC2=CC(=C(C=C2C(=O)O)C(=O)O)CC3=C(C(=C(C(=C3)C)C)C)C

InChI

InChI=1S/C30H34O4/c1-15-9-23(21(7)19(5)17(15)3)11-25-13-26(28(30(33)34)14-27(25)29(31)32)12-24-10-16(2)18(4)20(6)22(24)8/h9-10,13-14H,11-12H2,1-8H3,(H,31,32)(H,33,34)