5-[(E)-2-(2-chlorophenyl)ethenyl]-1,4,4-trimethyl-3-phenyl-pyrazol-1-ium iodide

Systemtic Name: 5-[(E)-2-(2-chlorophenyl)ethenyl]-1,4,4-trimethyl-3-phenyl-pyrazol-1-ium iodide Openeye Name: 5-[(E)-2-(2-chlorophenyl)vinyl]-1,4,4-trimethyl-3-phenyl-pyrazol-1-ium iodide CAS Name: 5-[(E)-2-(2-chlorophenyl)ethenyl]-1,4,4-trimethyl-3-phenylpyrazol-1-ium iodide IUPAC Name: 5-[(E)-2-(2-chlorophenyl)ethenyl]-1,4,4-trimethyl-3-phenylpyrazol-1-ium iodide Traditional Name: 5-[(E)-2-(2-chlorophenyl)vinyl]-1,4,4-trimethyl-3-phenyl-pyrazol-1-ium iodide Formula: C20H20ClIN2 MolecularWeight: 450.74367

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](N=C1C2=CC=CC=C2)C)C=CC3=CC=CC=C3Cl)C.[I-]

Isomeric SMILES

CC1(C(=[N+](N=C1C2=CC=CC=C2)C)/C=C/C3=CC=CC=C3Cl)C.[I-]

InChI

InChI=1S/C20H20ClN2.HI/c1-20(2)18(14-13-15-9-7-8-12-17(15)21)23(3)22-19(20)16-10-5-4-6-11-16;/h4-14H,1-3H3;1H/q+1;/p-1/b14-13+;