3-(2,3,4-tritert-butylphenyl)propanoic acid

Systemtic Name: 3-(2,3,4-tritert-butylphenyl)propanoic acid Openeye Name: 3-(2,3,4-tritert-butylphenyl)propanoic acid CAS Name: 3-(2,3,4-tritert-butylphenyl)propanoic acid IUPAC Name: 3-(2,3,4-tritert-butylphenyl)propanoic acid Traditional Name: 3-(2,3,4-tritert-butylphenyl)propionic acid Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)CCC(=O)O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)CCC(=O)O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C21H34O2/c1-19(2,3)15-12-10-14(11-13-16(22)23)17(20(4,5)6)18(15)21(7,8)9/h10,12H,11,13H2,1-9H3,(H,22,23)