ethyl 3-bromanyl-5-(3-oxidanylprop-1-ynyl)benzoate

Systemtic Name: ethyl 3-bromanyl-5-(3-oxidanylprop-1-ynyl)benzoate Openeye Name: ethyl 3-bromo-5-(3-hydroxyprop-1-ynyl)benzoate CAS Name: 3-bromo-5-(3-hydroxyprop-1-ynyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-5-(3-hydroxyprop-1-ynyl)benzoate Traditional Name: 3-bromo-5-(3-hydroxyprop-1-ynyl)benzoic acid ethyl ester Formula: C12H11BrO3 MolecularWeight: 283.11794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C#CCO)Br

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C#CCO)Br

InChI

InChI=1S/C12H11BrO3/c1-2-16-12(15)10-6-9(4-3-5-14)7-11(13)8-10/h6-8,14H,2,5H2,1H3