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

Systemtic Name: ethyl 4-[3-(3-ethanoyl-2H-imidazol-1-yl)propoxy]benzoate iodide Openeye Name: ethyl 4-[3-(3-acetyl-2H-imidazol-1-yl)propoxy]benzoate iodide CAS Name: 4-[3-(3-acetyl-2H-imidazol-1-yl)propoxy]benzoic acid ethyl ester iodide IUPAC Name: ethyl 4-[3-(3-acetyl-2H-imidazol-1-yl)propoxy]benzoate iodide Traditional Name: 4-[3-(3-acetyl-4-imidazolin-1-yl)propoxy]benzoic acid ethyl ester iodide Formula: C17H22IN2O4- MolecularWeight: 445.27205

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCCCN2CN(C=C2)C(=O)C.[I-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCCCN2CN(C=C2)C(=O)C.[I-]

InChI

InChI=1S/C17H22N2O4.HI/c1-3-22-17(21)15-5-7-16(8-6-15)23-12-4-9-18-10-11-19(13-18)14(2)20;/h5-8,10-11H,3-4,9,12-13H2,1-2H3;1H/p-1