[1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate

Systemtic Name: [1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate Openeye Name: [2-(4-bromophenyl)-1-methyl-2-oxo-ethyl] 5-(phenoxymethyl)furan-2-carboxylate CAS Name: 5-(phenoxymethyl)-2-furancarboxylic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromophenyl)-1-oxopropan-2-yl] 5-(phenoxymethyl)furan-2-carboxylate Traditional Name: 5-(phenoxymethyl)furan-2-carboxylic acid [2-(4-bromophenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H17BrO5 MolecularWeight: 429.26068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC=C(O2)COC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC=C(O2)COC3=CC=CC=C3

InChI

InChI=1S/C21H17BrO5/c1-14(20(23)15-7-9-16(22)10-8-15)26-21(24)19-12-11-18(27-19)13-25-17-5-3-2-4-6-17/h2-12,14H,13H2,1H3