[3-(3-phenylpropoxycarbonyl)phenyl] 5-bromanylfuran-2-carboxylate

Systemtic Name: [3-(3-phenylpropoxycarbonyl)phenyl] 5-bromanylfuran-2-carboxylate Openeye Name: [3-(3-phenylpropoxycarbonyl)phenyl] 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [3-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [3-(3-phenylpropoxycarbonyl)phenyl] 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [3-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C21H17BrO5 MolecularWeight: 429.26068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)C2=CC(=CC=C2)OC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)C2=CC(=CC=C2)OC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C21H17BrO5/c22-19-12-11-18(27-19)21(24)26-17-10-4-9-16(14-17)20(23)25-13-5-8-15-6-2-1-3-7-15/h1-4,6-7,9-12,14H,5,8,13H2