(2Z)-2-(1,3-dimethyl-4H-imidazol-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone

Systemtic Name: (2Z)-2-(1,3-dimethyl-4H-imidazol-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone Openeye Name: (2Z)-2-(1,3-dimethyl-4H-imidazol-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone CAS Name: (2Z)-2-(1,3-dimethyl-4H-imidazol-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone IUPAC Name: (2Z)-2-(1,3-dimethyl-4H-imidazol-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone Traditional Name: (2Z)-2-(1,3-dimethyl-3-imidazolin-1-ium-2-ylidene)-1-(4-iodophenyl)ethanone Formula: C13H14IN2O+ MolecularWeight: 341.16753

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=[N+](C1=CC(=O)C2=CC=C(C=C2)I)C

Isomeric SMILES

CN\1CC=[N+](/C1=C\C(=O)C2=CC=C(C=C2)I)C

InChI

InChI=1S/C13H14IN2O/c1-15-7-8-16(2)13(15)9-12(17)10-3-5-11(14)6-4-10/h3-7,9H,8H2,1-2H3/q+1/b13-9+