3-methylbut-2-enyl 4-bromanylbenzoate

Systemtic Name: 3-methylbut-2-enyl 4-bromanylbenzoate Openeye Name: 3-methylbut-2-enyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid 3-methylbut-2-enyl ester Formula: C12H13BrO2 MolecularWeight: 269.13442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrO2/c1-9(2)7-8-15-12(14)10-3-5-11(13)6-4-10/h3-7H,8H2,1-2H3