(5-ethanoyl-2-methoxy-phenyl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C15H14BrNO4 MolecularWeight: 352.17996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C15H14BrNO4/c1-9(18)10-3-4-14(20-2)11(5-10)8-21-15(19)13-6-12(16)7-17-13/h3-7,17H,8H2,1-2H3