ethyl 3-(4-bromophenyl)-2-[(E)-2-(2-methylphenyl)ethenyl]-5-oxidanylidene-furan-2-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)-2-[(E)-2-(2-methylphenyl)ethenyl]-5-oxidanylidene-furan-2-carboxylate Openeye Name: ethyl 3-(4-bromophenyl)-2-[(E)-2-(o-tolyl)vinyl]-5-oxo-furan-2-carboxylate CAS Name: 3-(4-bromophenyl)-2-[(E)-2-(2-methylphenyl)ethenyl]-5-oxo-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromophenyl)-2-[(E)-2-(2-methylphenyl)ethenyl]-5-oxofuran-2-carboxylate Traditional Name: 3-(4-bromophenyl)-5-keto-2-[(E)-2-(o-tolyl)vinyl]furan-2-carboxylic acid ethyl ester Formula: C22H19BrO4 MolecularWeight: 427.28786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=CC(=O)O1)C2=CC=C(C=C2)Br)C=CC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1(C(=CC(=O)O1)C2=CC=C(C=C2)Br)/C=C/C3=CC=CC=C3C

InChI

InChI=1S/C22H19BrO4/c1-3-26-21(25)22(13-12-16-7-5-4-6-15(16)2)19(14-20(24)27-22)17-8-10-18(23)11-9-17/h4-14H,3H2,1-2H3/b13-12+