3-[(2,4-ditert-butylphenoxy)methyl]benzoate

Systemtic Name: 3-[(2,4-ditert-butylphenoxy)methyl]benzoate Openeye Name: 3-[(2,4-ditert-butylphenoxy)methyl]benzoate CAS Name: 3-[(2,4-ditert-butylphenoxy)methyl]benzoate IUPAC Name: 3-[(2,4-ditert-butylphenoxy)methyl]benzoate Traditional Name: 3-[(2,4-ditert-butylphenoxy)methyl]benzoate Formula: C22H27O3- MolecularWeight: 339.44798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)[O-])C(C)(C)C

InChI

InChI=1S/C22H28O3/c1-21(2,3)17-10-11-19(18(13-17)22(4,5)6)25-14-15-8-7-9-16(12-15)20(23)24/h7-13H,14H2,1-6H3,(H,23,24)/p-1