(2-tert-butylphenyl) 2-(2,3,6-trimethylphenoxy)ethanoate

Systemtic Name: (2-tert-butylphenyl) 2-(2,3,6-trimethylphenoxy)ethanoate Openeye Name: (2-tert-butylphenyl) 2-(2,3,6-trimethylphenoxy)acetate CAS Name: 2-(2,3,6-trimethylphenoxy)acetic acid (2-tert-butylphenyl) ester IUPAC Name: (2-tert-butylphenyl) 2-(2,3,6-trimethylphenoxy)acetate Traditional Name: 2-(2,3,6-trimethylphenoxy)acetic acid (2-tert-butylphenyl) ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(=O)OC2=CC=CC=C2C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(=O)OC2=CC=CC=C2C(C)(C)C)C

InChI

InChI=1S/C21H26O3/c1-14-11-12-15(2)20(16(14)3)23-13-19(22)24-18-10-8-7-9-17(18)21(4,5)6/h7-12H,13H2,1-6H3