methyl 1-[(4-bromophenyl)methyl]-2-propyl-imidazole-4-carboxylate

Systemtic Name: methyl 1-[(4-bromophenyl)methyl]-2-propyl-imidazole-4-carboxylate Openeye Name: methyl 1-[(4-bromophenyl)methyl]-2-propyl-imidazole-4-carboxylate CAS Name: 1-[(4-bromophenyl)methyl]-2-propyl-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-bromophenyl)methyl]-2-propylimidazole-4-carboxylate Traditional Name: 1-(4-bromobenzyl)-2-propyl-imidazole-4-carboxylic acid methyl ester Formula: C15H17BrN2O2 MolecularWeight: 337.21168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=CN1CC2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CCCC1=NC(=CN1CC2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C15H17BrN2O2/c1-3-4-14-17-13(15(19)20-2)10-18(14)9-11-5-7-12(16)8-6-11/h5-8,10H,3-4,9H2,1-2H3