methyl 2-(4-bromophenyl)-2-(4-methyl-2-oxidanyl-5-oxidanylidene-3-phenylmethoxy-furan-2-yl)ethanoate

Systemtic Name: methyl 2-(4-bromophenyl)-2-(4-methyl-2-oxidanyl-5-oxidanylidene-3-phenylmethoxy-furan-2-yl)ethanoate Openeye Name: methyl 2-(3-benzyloxy-2-hydroxy-4-methyl-5-oxo-2-furyl)-2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)-2-(2-hydroxy-4-methyl-5-oxo-3-phenylmethoxy-2-furanyl)acetic acid methyl ester IUPAC Name: methyl 2-(4-bromophenyl)-2-(2-hydroxy-4-methyl-5-oxo-3-phenylmethoxyfuran-2-yl)acetate Traditional Name: 2-(3-benzoxy-2-hydroxy-5-keto-4-methyl-2-furyl)-2-(4-bromophenyl)acetic acid methyl ester Formula: C21H19BrO6 MolecularWeight: 447.27596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrO6/c1-13-18(27-12-14-6-4-3-5-7-14)21(25,28-19(13)23)17(20(24)26-2)15-8-10-16(22)11-9-15/h3-11,17,25H,12H2,1-2H3