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

Systemtic Name: 4-[(E)-2-(1,4-dimethylquinolin-1-ium-2-yl)ethenyl]-N,N-diethyl-aniline iodide Openeye Name: 4-[(E)-2-(1,4-dimethylquinolin-1-ium-2-yl)vinyl]-N,N-diethyl-aniline iodide CAS Name: 4-[(E)-2-(1,4-dimethyl-2-quinolin-1-iumyl)ethenyl]-N,N-diethylaniline iodide IUPAC Name: 4-[(E)-2-(1,4-dimethylquinolin-1-ium-2-yl)ethenyl]-N,N-diethylaniline iodide Traditional Name: [4-[(E)-2-(1,4-dimethylquinolin-1-ium-2-yl)vinyl]phenyl]-diethyl-amine iodide Formula: C23H27IN2 MolecularWeight: 458.37835

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=CC2=[N+](C3=CC=CC=C3C(=C2)C)C.[I-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C/C2=[N+](C3=CC=CC=C3C(=C2)C)C.[I-]

InChI

InChI=1S/C23H27N2.HI/c1-5-25(6-2)20-14-11-19(12-15-20)13-16-21-17-18(3)22-9-7-8-10-23(22)24(21)4;/h7-17H,5-6H2,1-4H3;1H/q+1;/p-1