(2Z)-2-[(E)-3-(1-butylquinolin-1-ium-4-yl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide

Systemtic Name: (2Z)-2-[(E)-3-(1-butylquinolin-1-ium-4-yl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide Openeye Name: (2Z)-2-[(E)-3-(1-butylquinolin-1-ium-4-yl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide CAS Name: (2Z)-2-[(E)-3-(1-butyl-4-quinolin-1-iumyl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide IUPAC Name: (2Z)-2-[(E)-3-(1-butylquinolin-1-ium-4-yl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide Traditional Name: (2Z)-2-[(E)-3-(1-butylquinolin-1-ium-4-yl)prop-2-enylidene]-3-ethyl-1,3-benzoselenazole iodide Formula: C25H27IN2Se MolecularWeight: 561.35975

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=C(C2=CC=CC=C21)C=CC=C3N(C4=CC=CC=C4[Se]3)CC.[I-]

Isomeric SMILES

CCCC[N+]1=CC=C(C2=CC=CC=C21)/C=C/C=C\3/N(C4=CC=CC=C4[Se]3)CC.[I-]

InChI

InChI=1S/C25H27N2Se.HI/c1-3-5-18-26-19-17-20(21-12-6-7-13-22(21)26)11-10-16-25-27(4-2)23-14-8-9-15-24(23)28-25;/h6-17,19H,3-5,18H2,1-2H3;1H/q+1;/p-1