4-(1,6-dimethylquinolin-1-ium-2-yl)-N,N-diethyl-aniline iodide

Systemtic Name: 4-(1,6-dimethylquinolin-1-ium-2-yl)-N,N-diethyl-aniline iodide Openeye Name: 4-(1,6-dimethylquinolin-1-ium-2-yl)-N,N-diethyl-aniline iodide CAS Name: 4-(1,6-dimethyl-2-quinolin-1-iumyl)-N,N-diethylaniline iodide IUPAC Name: 4-(1,6-dimethylquinolin-1-ium-2-yl)-N,N-diethylaniline iodide Traditional Name: [4-(1,6-dimethylquinolin-1-ium-2-yl)phenyl]-diethyl-amine iodide Formula: C21H25IN2 MolecularWeight: 432.34107

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N2.HI/c1-5-23(6-2)19-11-8-17(9-12-19)20-14-10-18-15-16(3)7-13-21(18)22(20)4;/h7-15H,5-6H2,1-4H3;1H/q+1;/p-1