ethyl 4-[3-(3-ethanoyl-2H-imidazol-1-yl)propyl]benzoate iodide

Systemtic Name: ethyl 4-[3-(3-ethanoyl-2H-imidazol-1-yl)propyl]benzoate iodide Openeye Name: ethyl 4-[3-(3-acetyl-2H-imidazol-1-yl)propyl]benzoate iodide CAS Name: 4-[3-(3-acetyl-2H-imidazol-1-yl)propyl]benzoic acid ethyl ester iodide IUPAC Name: ethyl 4-[3-(3-acetyl-2H-imidazol-1-yl)propyl]benzoate iodide Traditional Name: 4-[3-(3-acetyl-4-imidazolin-1-yl)propyl]benzoic acid ethyl ester iodide Formula: C17H22IN2O3- MolecularWeight: 429.27265

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCCN2CN(C=C2)C(=O)C.[I-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCCN2CN(C=C2)C(=O)C.[I-]

InChI

InChI=1S/C17H22N2O3.HI/c1-3-22-17(21)16-8-6-15(7-9-16)5-4-10-18-11-12-19(13-18)14(2)20;/h6-9,11-12H,3-5,10,13H2,1-2H3;1H/p-1