2-methyl-4-[1,2,2-tris(4-carboxy-3-methyl-phenyl)ethyl]benzoic acid

Systemtic Name: 2-methyl-4-[1,2,2-tris(4-carboxy-3-methyl-phenyl)ethyl]benzoic acid Openeye Name: 2-methyl-4-[1,2,2-tris(4-carboxy-3-methyl-phenyl)ethyl]benzoic acid CAS Name: 2-methyl-4-[1,2,2-tris(4-carboxy-3-methylphenyl)ethyl]benzoic acid IUPAC Name: 2-methyl-4-[1,2,2-tris(4-carboxy-3-methylphenyl)ethyl]benzoic acid Traditional Name: 2-methyl-4-[1,2,2-tris(4-carboxy-3-methyl-phenyl)ethyl]benzoic acid Formula: C34H30O8 MolecularWeight: 566.5972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)C(=O)O)C)C(C3=CC(=C(C=C3)C(=O)O)C)C4=CC(=C(C=C4)C(=O)O)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)C(=O)O)C)C(C3=CC(=C(C=C3)C(=O)O)C)C4=CC(=C(C=C4)C(=O)O)C)C(=O)O

InChI

InChI=1S/C34H30O8/c1-17-13-21(5-9-25(17)31(35)36)29(22-6-10-26(32(37)38)18(2)14-22)30(23-7-11-27(33(39)40)19(3)15-23)24-8-12-28(34(41)42)20(4)16-24/h5-16,29-30H,1-4H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42)