2-[(E)-2-[5-(3-chloranyl-4-methoxy-phenyl)furan-2-yl]ethenyl]-1-methyl-pyridin-1-ium iodide

Systemtic Name: 2-[(E)-2-[5-(3-chloranyl-4-methoxy-phenyl)furan-2-yl]ethenyl]-1-methyl-pyridin-1-ium iodide Openeye Name: 2-[(E)-2-[5-(3-chloro-4-methoxy-phenyl)-2-furyl]vinyl]-1-methyl-pyridin-1-ium iodide CAS Name: 2-[(E)-2-[5-(3-chloro-4-methoxyphenyl)-2-furanyl]ethenyl]-1-methylpyridin-1-ium iodide IUPAC Name: 2-[(E)-2-[5-(3-chloro-4-methoxyphenyl)furan-2-yl]ethenyl]-1-methylpyridin-1-ium iodide Traditional Name: 2-[(E)-2-[5-(3-chloro-4-methoxy-phenyl)-2-furyl]vinyl]-1-methyl-pyridin-1-ium iodide Formula: C19H17ClINO2 MolecularWeight: 453.70125

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=CC2=CC=C(O2)C3=CC(=C(C=C3)OC)Cl.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1/C=C/C2=CC=C(O2)C3=CC(=C(C=C3)OC)Cl.[I-]

InChI

InChI=1S/C19H17ClNO2.HI/c1-21-12-4-3-5-15(21)7-8-16-9-11-18(23-16)14-6-10-19(22-2)17(20)13-14;/h3-13H,1-2H3;1H/q+1;/p-1/b8-7+;