methyl 2-[4-(3-bromanylpropoxy)-3-propanoyl-phenyl]ethanoate

Systemtic Name: methyl 2-[4-(3-bromanylpropoxy)-3-propanoyl-phenyl]ethanoate Openeye Name: methyl 2-[4-(3-bromopropoxy)-3-propanoyl-phenyl]acetate CAS Name: 2-[4-(3-bromopropoxy)-3-(1-oxopropyl)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-bromopropoxy)-3-propanoylphenyl]acetate Traditional Name: 2-[4-(3-bromopropoxy)-3-propionyl-phenyl]acetic acid methyl ester Formula: C15H19BrO4 MolecularWeight: 343.21296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)CC(=O)OC)OCCCBr

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)CC(=O)OC)OCCCBr

InChI

InChI=1S/C15H19BrO4/c1-3-13(17)12-9-11(10-15(18)19-2)5-6-14(12)20-8-4-7-16/h5-6,9H,3-4,7-8,10H2,1-2H3