pentan-2-yl 4-bromanylbenzoate

Systemtic Name: pentan-2-yl 4-bromanylbenzoate Openeye Name: 1-methylbutyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid 1-methylbutyl ester Formula: C12H15BrO2 MolecularWeight: 271.1503

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCC(C)OC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C12H15BrO2/c1-3-4-9(2)15-12(14)10-5-7-11(13)8-6-10/h5-9H,3-4H2,1-2H3