3,4-bis(4-tert-butylcyclohexyl)phthalic acid

Systemtic Name: 3,4-bis(4-tert-butylcyclohexyl)phthalic acid Openeye Name: 3,4-bis(4-tert-butylcyclohexyl)phthalic acid CAS Name: 3,4-bis(4-tert-butylcyclohexyl)phthalic acid IUPAC Name: 3,4-bis(4-tert-butylcyclohexyl)phthalic acid Traditional Name: 3,4-bis(4-tert-butylcyclohexyl)phthalic acid Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C3CCC(CC3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C3CCC(CC3)C(C)(C)C

InChI

InChI=1S/C28H42O4/c1-27(2,3)19-11-7-17(8-12-19)21-15-16-22(25(29)30)24(26(31)32)23(21)18-9-13-20(14-10-18)28(4,5)6/h15-20H,7-14H2,1-6H3,(H,29,30)(H,31,32)