ethyl 2-[3-[[2-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[3-[[2-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenoxy]ethanoate Openeye Name: ethyl 2-[3-[[2-(4-bromo-3-methyl-phenyl)-5-oxo-oxazol-4-ylidene]methyl]phenoxy]acetate CAS Name: 2-[3-[[2-(4-bromo-3-methylphenyl)-5-oxo-4-oxazolylidene]methyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[2-(4-bromo-3-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenoxy]acetate Traditional Name: 2-[3-[[2-(4-bromo-3-methyl-phenyl)-5-keto-2-oxazolin-4-ylidene]methyl]phenoxy]acetic acid ethyl ester Formula: C21H18BrNO5 MolecularWeight: 444.27532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCOC(=O)COC1=CC=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C21H18BrNO5/c1-3-26-19(24)12-27-16-6-4-5-14(10-16)11-18-21(25)28-20(23-18)15-7-8-17(22)13(2)9-15/h4-11H,3,12H2,1-2H3