(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-(3-bromanyl-4-methoxy-phenyl)ethanoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-(3-bromanyl-4-methoxy-phenyl)ethanoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 2-(3-bromo-4-methoxy-phenyl)acetate CAS Name: 2-(3-bromo-4-methoxyphenyl)acetic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 2-(3-bromo-4-methoxyphenyl)acetate Traditional Name: 2-(3-bromo-4-methoxy-phenyl)acetic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C21H17BrO4 MolecularWeight: 413.26128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C21H17BrO4/c1-25-20-9-6-14(10-18(20)22)11-21(24)26-13-19(23)17-8-7-15-4-2-3-5-16(15)12-17/h2-10,12H,11,13H2,1H3