(6-bromanylnaphthalen-2-yl) 2-(2,4,6-trimethylphenoxy)ethanoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 2-(2,4,6-trimethylphenoxy)ethanoate Openeye Name: (6-bromo-2-naphthyl) 2-(2,4,6-trimethylphenoxy)acetate CAS Name: 2-(2,4,6-trimethylphenoxy)acetic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 2-(2,4,6-trimethylphenoxy)acetate Traditional Name: 2-(2,4,6-trimethylphenoxy)acetic acid (6-bromo-2-naphthyl) ester Formula: C21H19BrO3 MolecularWeight: 399.27776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)C

InChI

InChI=1S/C21H19BrO3/c1-13-8-14(2)21(15(3)9-13)24-12-20(23)25-19-7-5-16-10-18(22)6-4-17(16)11-19/h4-11H,12H2,1-3H3