(2E)-2-[(1-ethylpyridin-1-ium-2-yl)methylidene]-6-methyl-1-prop-2-enyl-quinoline iodide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC=C1C=C2C=CC3=C(N2CC=C)C=CC(=C3)C.[I-]

Isomeric SMILES

CC[N+]1=CC=CC=C1/C=C/2\C=CC3=C(N2CC=C)C=CC(=C3)C.[I-]

InChI

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