N,N-dibutyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline iodide

Systemtic Name: N,N-dibutyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline iodide Openeye Name: N,N-dibutyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]aniline iodide CAS Name: N,N-dibutyl-4-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]aniline iodide IUPAC Name: N,N-dibutyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline iodide Traditional Name: dibutyl-[4-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]phenyl]amine iodide Formula: C22H31IN2 MolecularWeight: 450.39941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)C.[I-]

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)/C=C/C2=CC=[N+](C=C2)C.[I-]

InChI

InChI=1S/C22H31N2.HI/c1-4-6-16-24(17-7-5-2)22-12-10-20(11-13-22)8-9-21-14-18-23(3)19-15-21;/h8-15,18-19H,4-7,16-17H2,1-3H3;1H/q+1;/p-1