N,N-dimethyl-4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenyl-ethyl]aniline iodide

Systemtic Name: N,N-dimethyl-4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenyl-ethyl]aniline iodide Openeye Name: N,N-dimethyl-4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenyl-ethyl]aniline iodide CAS Name: N,N-dimethyl-4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenylethyl]aniline iodide IUPAC Name: N,N-dimethyl-4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenylethyl]aniline iodide Traditional Name: dimethyl-[4-[(2E)-2-(1-methyl-1H-quinolin-1-ium-2-ylidene)-1-phenyl-ethyl]phenyl]amine iodide Formula: C26H27IN2 MolecularWeight: 494.41045

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C(=CC(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C)C=CC4=CC=CC=C41.[I-]

Isomeric SMILES

C[NH+]1/C(=C/C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C)/C=CC4=CC=CC=C41.[I-]

InChI

InChI=1S/C26H26N2.HI/c1-27(2)23-16-13-21(14-17-23)25(20-9-5-4-6-10-20)19-24-18-15-22-11-7-8-12-26(22)28(24)3;/h4-19,25H,1-3H3;1H/b24-19+;