bromanyl 5-methyl-1-(3-oxidanylpropyl)imidazole-4-carboxylate

Systemtic Name: bromanyl 5-methyl-1-(3-oxidanylpropyl)imidazole-4-carboxylate Openeye Name: bromo 1-(3-hydroxypropyl)-5-methyl-imidazole-4-carboxylate CAS Name: 1-(3-hydroxypropyl)-5-methyl-4-imidazolecarboxylic acid bromo ester IUPAC Name: bromo 1-(3-hydroxypropyl)-5-methylimidazole-4-carboxylate Traditional Name: 1-(3-hydroxypropyl)-5-methyl-imidazole-4-carboxylic acid bromo ester Formula: C8H11BrN2O3 MolecularWeight: 263.08854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1CCCO)C(=O)OBr

Isomeric SMILES

CC1=C(N=CN1CCCO)C(=O)OBr

InChI

InChI=1S/C8H11BrN2O3/c1-6-7(8(13)14-9)10-5-11(6)3-2-4-12/h5,12H,2-4H2,1H3