2-[4-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]acetate CAS Name: 2-[4-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]phenyl]acetate IUPAC Name: 2-[4-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]acetate Formula: C20H22BrO3- MolecularWeight: 390.29088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)CC(=O)[O-])C(C)(C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)CC(=O)[O-])C(C)(C)C)Br

InChI

InChI=1S/C20H23BrO3/c1-13-9-16(21)11-17(20(2,3)4)19(13)24-12-15-7-5-14(6-8-15)10-18(22)23/h5-9,11H,10,12H2,1-4H3,(H,22,23)/p-1