methyl (3R)-8-bromanyl-3-phenacyl-octanoate

Systemtic Name: methyl (3R)-8-bromanyl-3-phenacyl-octanoate Openeye Name: methyl (3R)-8-bromo-3-phenacyl-octanoate CAS Name: (3R)-8-bromo-3-phenacyloctanoic acid methyl ester IUPAC Name: methyl (3R)-8-bromo-3-phenacyloctanoate Traditional Name: (3R)-8-bromo-3-phenacyl-caprylic acid methyl ester Formula: C17H23BrO3 MolecularWeight: 355.26672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CCCCCBr)CC(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)C[C@H](CCCCCBr)CC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H23BrO3/c1-21-17(20)13-14(8-4-3-7-11-18)12-16(19)15-9-5-2-6-10-15/h2,5-6,9-10,14H,3-4,7-8,11-13H2,1H3/t14-/m1/s1