methyl 4-[(Z)-[2-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[2-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[2-(4-bromo-3-methyl-phenyl)-5-oxo-oxazol-4-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[2-(4-bromo-3-methylphenyl)-5-oxo-4-oxazolylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[2-(4-bromo-3-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[2-(4-bromo-3-methyl-phenyl)-5-keto-2-oxazolin-4-ylidene]methyl]benzoic acid methyl ester Formula: C19H14BrNO4 MolecularWeight: 400.22276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2=N/C(=C\C3=CC=C(C=C3)C(=O)OC)/C(=O)O2)Br

InChI

InChI=1S/C19H14BrNO4/c1-11-9-14(7-8-15(11)20)17-21-16(19(23)25-17)10-12-3-5-13(6-4-12)18(22)24-2/h3-10H,1-2H3/b16-10-