methyl 5-(2-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(2-bromanyl-4-methoxy-phenyl)-3-oxidanylidene-pentanoate Openeye Name: methyl 5-(2-bromo-4-methoxy-phenyl)-3-oxo-pentanoate CAS Name: 5-(2-bromo-4-methoxyphenyl)-3-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2-bromo-4-methoxyphenyl)-3-oxopentanoate Traditional Name: 5-(2-bromo-4-methoxy-phenyl)-3-keto-valeric acid methyl ester Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO4/c1-17-11-6-4-9(12(14)8-11)3-5-10(15)7-13(16)18-2/h4,6,8H,3,5,7H2,1-2H3