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

Systemtic Name: 2-[(2-bromanyl-6-tert-butyl-4-methyl-phenoxy)methyl]benzoate Openeye Name: 2-[(2-bromo-6-tert-butyl-4-methyl-phenoxy)methyl]benzoate CAS Name: 2-[(2-bromo-6-tert-butyl-4-methylphenoxy)methyl]benzoate IUPAC Name: 2-[(2-bromo-6-tert-butyl-4-methylphenoxy)methyl]benzoate Traditional Name: 2-[(2-bromo-6-tert-butyl-4-methyl-phenoxy)methyl]benzoate Formula: C19H20BrO3- MolecularWeight: 376.2643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2C(=O)[O-])C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2C(=O)[O-])C(C)(C)C

InChI

InChI=1S/C19H21BrO3/c1-12-9-15(19(2,3)4)17(16(20)10-12)23-11-13-7-5-6-8-14(13)18(21)22/h5-10H,11H2,1-4H3,(H,21,22)/p-1