(2-bromophenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (2-bromophenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (2-bromophenyl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (2-bromobenzyl) ester Formula: C15H14BrNO3 MolecularWeight: 336.18056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=CC=C2Br)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=CC=C2Br)C

InChI

InChI=1S/C15H14BrNO3/c1-10(18)12-7-14(17(2)8-12)15(19)20-9-11-5-3-4-6-13(11)16/h3-8H,9H2,1-2H3