ethyl 2-[(4-bromanyl-3-methyl-phenyl)diazenyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(4-bromanyl-3-methyl-phenyl)diazenyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(4-bromo-3-methyl-phenyl)azo-3-oxo-butanoate CAS Name: 2-(4-bromo-3-methylphenyl)azo-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromo-3-methylphenyl)diazenyl]-3-oxobutanoate Traditional Name: 2-(4-bromo-3-methyl-phenyl)azo-3-keto-butyric acid ethyl ester Formula: C13H15BrN2O3 MolecularWeight: 327.1738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)N=NC1=CC(=C(C=C1)Br)C

Isomeric SMILES

CCOC(=O)C(C(=O)C)N=NC1=CC(=C(C=C1)Br)C

InChI

InChI=1S/C13H15BrN2O3/c1-4-19-13(18)12(9(3)17)16-15-10-5-6-11(14)8(2)7-10/h5-7,12H,4H2,1-3H3