ethyl 6-bromanyl-5-[(3-nitrophenyl)methoxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-[(3-nitrophenyl)methoxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-[(3-nitrophenyl)methoxy]-2-phenyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-[(3-nitrophenyl)methoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-[(3-nitrophenyl)methoxy]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(3-nitrobenzyl)oxy-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C24H18BrNO6 MolecularWeight: 496.30682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC(=CC=C3)[N+](=O)[O-])Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC(=CC=C3)[N+](=O)[O-])Br)C4=CC=CC=C4

InChI

InChI=1S/C24H18BrNO6/c1-2-30-24(27)22-18-12-21(31-14-15-7-6-10-17(11-15)26(28)29)19(25)13-20(18)32-23(22)16-8-4-3-5-9-16/h3-13H,2,14H2,1H3