ethyl 3-(3-bromanyl-2-oxidanyl-propoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3-(3-bromanyl-2-oxidanyl-propoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3-(3-bromo-2-hydroxy-propoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 3-(3-bromo-2-hydroxypropoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-bromo-2-hydroxypropoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 3-(3-bromo-2-hydroxy-propoxy)-4,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C12H18BrNO4 MolecularWeight: 320.17962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C)OCC(CBr)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C)OCC(CBr)O

InChI

InChI=1S/C12H18BrNO4/c1-4-17-12(16)10-11(7(2)8(3)14-10)18-6-9(15)5-13/h9,14-15H,4-6H2,1-3H3