12-(4-tert-butylphenoxy)-2,2-bis(chloranyl)dodecanoic acid

Systemtic Name: 12-(4-tert-butylphenoxy)-2,2-bis(chloranyl)dodecanoic acid Openeye Name: 12-(4-tert-butylphenoxy)-2,2-dichloro-dodecanoic acid CAS Name: 12-(4-tert-butylphenoxy)-2,2-dichlorododecanoic acid IUPAC Name: 12-(4-tert-butylphenoxy)-2,2-dichlorododecanoic acid Traditional Name: 12-(4-tert-butylphenoxy)-2,2-dichloro-lauric acid Formula: C22H34Cl2O3 MolecularWeight: 417.40956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCCCCCCCCC(C(=O)O)(Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCCCCCCCCC(C(=O)O)(Cl)Cl

InChI

InChI=1S/C22H34Cl2O3/c1-21(2,3)18-12-14-19(15-13-18)27-17-11-9-7-5-4-6-8-10-16-22(23,24)20(25)26/h12-15H,4-11,16-17H2,1-3H3,(H,25,26)