(3-pyrrol-1-ylphenyl)methyl 2-bromanylethanoate

Systemtic Name: (3-pyrrol-1-ylphenyl)methyl 2-bromanylethanoate Openeye Name: (3-pyrrol-1-ylphenyl)methyl 2-bromoacetate CAS Name: 2-bromoacetic acid [3-(1-pyrrolyl)phenyl]methyl ester IUPAC Name: (3-pyrrol-1-ylphenyl)methyl 2-bromoacetate Traditional Name: 2-bromoacetic acid (3-pyrrol-1-ylbenzyl) ester Formula: C13H12BrNO2 MolecularWeight: 294.14388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=CC(=C2)COC(=O)CBr

Isomeric SMILES

C1=CN(C=C1)C2=CC=CC(=C2)COC(=O)CBr

InChI

InChI=1S/C13H12BrNO2/c14-9-13(16)17-10-11-4-3-5-12(8-11)15-6-1-2-7-15/h1-8H,9-10H2