2-methyl-5-propan-2-yl-terephthalic acid

Systemtic Name: 2-methyl-5-propan-2-yl-terephthalic acid Openeye Name: 2-isopropyl-5-methyl-terephthalic acid CAS Name: 2-methyl-5-propan-2-ylterephthalic acid IUPAC Name: 2-methyl-5-propan-2-ylterephthalic acid Traditional Name: 2-isopropyl-5-methyl-terephthalic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=O)O)C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(C(=C1)C(=O)O)C(C)C)C(=O)O

InChI

InChI=1S/C12H14O4/c1-6(2)8-5-9(11(13)14)7(3)4-10(8)12(15)16/h4-6H,1-3H3,(H,13,14)(H,15,16)