methyl (2E)-2-(4-bromophenyl)-2-(4-methyl-5-oxidanylidene-3-phenylmethoxy-furan-2-ylidene)ethanoate

Systemtic Name: methyl (2E)-2-(4-bromophenyl)-2-(4-methyl-5-oxidanylidene-3-phenylmethoxy-furan-2-ylidene)ethanoate Openeye Name: methyl (2E)-2-(3-benzyloxy-4-methyl-5-oxo-2-furylidene)-2-(4-bromophenyl)acetate CAS Name: (2E)-2-(4-bromophenyl)-2-(4-methyl-5-oxo-3-phenylmethoxy-2-furanylidene)acetic acid methyl ester IUPAC Name: methyl (2E)-2-(4-bromophenyl)-2-(4-methyl-5-oxo-3-phenylmethoxyfuran-2-ylidene)acetate Traditional Name: (2E)-2-(3-benzoxy-5-keto-4-methyl-2-furylidene)-2-(4-bromophenyl)acetic acid methyl ester Formula: C21H17BrO5 MolecularWeight: 429.26068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=CC=C(C=C2)Br)C(=O)OC)OC1=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(/C(=C(/C2=CC=C(C=C2)Br)\C(=O)OC)/OC1=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H17BrO5/c1-13-18(26-12-14-6-4-3-5-7-14)19(27-20(13)23)17(21(24)25-2)15-8-10-16(22)11-9-15/h3-11H,12H2,1-2H3/b19-17+