ethyl 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylate CAS Name: 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylate Traditional Name: 5-(bromomethyl)-3-methyl-4-propyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C12H18BrNO2 MolecularWeight: 288.18082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C)C(=O)OCC)CBr

Isomeric SMILES

CCCC1=C(NC(=C1C)C(=O)OCC)CBr

InChI

InChI=1S/C12H18BrNO2/c1-4-6-9-8(3)11(12(15)16-5-2)14-10(9)7-13/h14H,4-7H2,1-3H3