ethyl 7-bromanyl-2-phenyl-benzo[e][1]benzofuran-1-carboxylate

Systemtic Name: ethyl 7-bromanyl-2-phenyl-benzo[e][1]benzofuran-1-carboxylate Openeye Name: ethyl 7-bromo-2-phenyl-benzo[e]benzofuran-1-carboxylate CAS Name: 7-bromo-2-phenyl-1-benzo[e]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-2-phenylbenzo[e][1]benzofuran-1-carboxylate Traditional Name: 7-bromo-2-phenyl-benzo[e]benzofuran-1-carboxylic acid ethyl ester Formula: C21H15BrO3 MolecularWeight: 395.246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C3=C(C=C2)C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C3=C(C=C2)C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H15BrO3/c1-2-24-21(23)19-18-16-10-9-15(22)12-14(16)8-11-17(18)25-20(19)13-6-4-3-5-7-13/h3-12H,2H2,1H3