ethyl 3-[(4-iodophenyl)methyl]-5-methyl-imidazole-4-carboxylate

Systemtic Name: ethyl 3-[(4-iodophenyl)methyl]-5-methyl-imidazole-4-carboxylate Openeye Name: ethyl 3-[(4-iodophenyl)methyl]-5-methyl-imidazole-4-carboxylate CAS Name: 3-[(4-iodophenyl)methyl]-5-methyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-iodophenyl)methyl]-5-methylimidazole-4-carboxylate Traditional Name: 3-(4-iodobenzyl)-5-methyl-imidazole-4-carboxylic acid ethyl ester Formula: C14H15IN2O2 MolecularWeight: 370.18557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CN1CC2=CC=C(C=C2)I)C

Isomeric SMILES

CCOC(=O)C1=C(N=CN1CC2=CC=C(C=C2)I)C

InChI

InChI=1S/C14H15IN2O2/c1-3-19-14(18)13-10(2)16-9-17(13)8-11-4-6-12(15)7-5-11/h4-7,9H,3,8H2,1-2H3