(2-methanoylnaphthalen-1-yl) 2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoate

Systemtic Name: (2-methanoylnaphthalen-1-yl) 2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoate Openeye Name: (2-formyl-1-naphthyl) 2-(4-bromo-2,6-dimethyl-phenoxy)acetate CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)acetic acid (2-formyl-1-naphthalenyl) ester IUPAC Name: (2-formylnaphthalen-1-yl) 2-(4-bromo-2,6-dimethylphenoxy)acetate Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)acetic acid (2-formyl-1-naphthyl) ester Formula: C21H17BrO4 MolecularWeight: 413.26128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)OC2=C(C=CC3=CC=CC=C32)C=O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)OC2=C(C=CC3=CC=CC=C32)C=O)C)Br

InChI

InChI=1S/C21H17BrO4/c1-13-9-17(22)10-14(2)20(13)25-12-19(24)26-21-16(11-23)8-7-15-5-3-4-6-18(15)21/h3-11H,12H2,1-2H3