methyl 6-bromanyl-2-(4-hydroxyphenyl)-3-oxidanylidene-hexanoate

Systemtic Name: methyl 6-bromanyl-2-(4-hydroxyphenyl)-3-oxidanylidene-hexanoate Openeye Name: methyl 6-bromo-2-(4-hydroxyphenyl)-3-oxo-hexanoate CAS Name: 6-bromo-2-(4-hydroxyphenyl)-3-oxohexanoic acid methyl ester IUPAC Name: methyl 6-bromo-2-(4-hydroxyphenyl)-3-oxohexanoate Traditional Name: 6-bromo-2-(4-hydroxyphenyl)-3-keto-hexanoic acid methyl ester Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)O)C(=O)CCCBr

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)O)C(=O)CCCBr

InChI

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