methyl 4-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-butanoate

Systemtic Name: methyl 4-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-butanoate Openeye Name: methyl 4-(3-bromo-4-methoxy-phenyl)-2-oxo-butanoate CAS Name: 4-(3-bromo-4-methoxyphenyl)-2-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4-methoxyphenyl)-2-oxobutanoate Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-2-keto-butyric acid methyl ester Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)C(=O)OC)Br

InChI

InChI=1S/C12H13BrO4/c1-16-11-6-4-8(7-9(11)13)3-5-10(14)12(15)17-2/h4,6-7H,3,5H2,1-2H3