methyl 3-[[5-(4-iodophenyl)imidazol-1-yl]methyl]benzoate

Systemtic Name: methyl 3-[[5-(4-iodophenyl)imidazol-1-yl]methyl]benzoate Openeye Name: methyl 3-[[5-(4-iodophenyl)imidazol-1-yl]methyl]benzoate CAS Name: 3-[[5-(4-iodophenyl)-1-imidazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[5-(4-iodophenyl)imidazol-1-yl]methyl]benzoate Traditional Name: 3-[[5-(4-iodophenyl)imidazol-1-yl]methyl]benzoic acid methyl ester Formula: C18H15IN2O2 MolecularWeight: 418.22837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2C=NC=C2C3=CC=C(C=C3)I

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2C=NC=C2C3=CC=C(C=C3)I

InChI

InChI=1S/C18H15IN2O2/c1-23-18(22)15-4-2-3-13(9-15)11-21-12-20-10-17(21)14-5-7-16(19)8-6-14/h2-10,12H,11H2,1H3