(2E)-1-ethyl-6-methyl-2-[(1-prop-2-enylpyridin-1-ium-4-yl)methylidene]quinoline iodide

Systemtic Name: (2E)-1-ethyl-6-methyl-2-[(1-prop-2-enylpyridin-1-ium-4-yl)methylidene]quinoline iodide Openeye Name: (2E)-2-[(1-allylpyridin-1-ium-4-yl)methylene]-1-ethyl-6-methyl-quinoline iodide CAS Name: (2E)-1-ethyl-6-methyl-2-[(1-prop-2-enyl-4-pyridin-1-iumyl)methylidene]quinoline iodide IUPAC Name: (2E)-1-ethyl-6-methyl-2-[(1-prop-2-enylpyridin-1-ium-4-yl)methylidene]quinoline iodide Traditional Name: (2E)-2-[(1-allylpyridin-1-ium-4-yl)methylene]-1-ethyl-6-methyl-quinoline iodide Formula: C21H23IN2 MolecularWeight: 430.32519

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=CC=[N+](C=C2)CC=C)C=CC3=C1C=CC(=C3)C.[I-]

Isomeric SMILES

CCN1/C(=C/C2=CC=[N+](C=C2)CC=C)/C=CC3=C1C=CC(=C3)C.[I-]

InChI

InChI=1S/C21H23N2.HI/c1-4-12-22-13-10-18(11-14-22)16-20-8-7-19-15-17(3)6-9-21(19)23(20)5-2;/h4,6-11,13-16H,1,5,12H2,2-3H3;1H/q+1;/p-1