2-[4-[(4-bromanyl-2,3,5-trimethyl-phenoxy)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(4-bromanyl-2,3,5-trimethyl-phenoxy)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(4-bromo-2,3,5-trimethyl-phenoxy)methyl]phenyl]acetate CAS Name: 2-[4-[(4-bromo-2,3,5-trimethylphenoxy)methyl]phenyl]acetate IUPAC Name: 2-[4-[(4-bromo-2,3,5-trimethylphenoxy)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-bromo-2,3,5-trimethyl-phenoxy)methyl]phenyl]acetate Formula: C18H18BrO3- MolecularWeight: 362.23772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC2=CC=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC2=CC=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C18H19BrO3/c1-11-8-16(12(2)13(3)18(11)19)22-10-15-6-4-14(5-7-15)9-17(20)21/h4-8H,9-10H2,1-3H3,(H,20,21)/p-1