ethyl 4-(4-bromanyl-2-methyl-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(4-bromanyl-2-methyl-phenyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(4-bromo-2-methyl-phenyl)-4-oxo-butanoate CAS Name: 4-(4-bromo-2-methylphenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-2-methylphenyl)-4-oxobutanoate Traditional Name: 4-(4-bromo-2-methyl-phenyl)-4-keto-butyric acid ethyl ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=C(C=C(C=C1)Br)C

Isomeric SMILES

CCOC(=O)CCC(=O)C1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C13H15BrO3/c1-3-17-13(16)7-6-12(15)11-5-4-10(14)8-9(11)2/h4-5,8H,3,6-7H2,1-2H3