3-(4-bromanyl-2-cyano-phenyl)propyl ethanoate

Systemtic Name: 3-(4-bromanyl-2-cyano-phenyl)propyl ethanoate Openeye Name: 3-(4-bromo-2-cyano-phenyl)propyl acetate CAS Name: acetic acid 3-(4-bromo-2-cyanophenyl)propyl ester IUPAC Name: 3-(4-bromo-2-cyanophenyl)propyl acetate Traditional Name: acetic acid 3-(4-bromo-2-cyano-phenyl)propyl ester Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC1=C(C=C(C=C1)Br)C#N

Isomeric SMILES

CC(=O)OCCCC1=C(C=C(C=C1)Br)C#N

InChI

InChI=1S/C12H12BrNO2/c1-9(15)16-6-2-3-10-4-5-12(13)7-11(10)8-14/h4-5,7H,2-3,6H2,1H3