1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]quinolin-1-ium iodide

Systemtic Name: 1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]quinolin-1-ium iodide Openeye Name: 1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)-2-furyl]vinyl]quinolin-1-ium iodide CAS Name: 1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)-2-furanyl]ethenyl]quinolin-1-ium iodide IUPAC Name: 1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]quinolin-1-ium iodide Traditional Name: 1-ethyl-2-[(E)-2-[5-(4-nitrophenyl)-2-furyl]vinyl]quinolin-1-ium iodide Formula: C23H19IN2O3 MolecularWeight: 498.31303

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC2=CC=CC=C21)C=CC3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-].[I-]

Isomeric SMILES

CC[N+]1=C(C=CC2=CC=CC=C21)/C=C/C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-].[I-]

InChI

InChI=1S/C23H19N2O3.HI/c1-2-24-19(10-7-17-5-3-4-6-22(17)24)13-14-21-15-16-23(28-21)18-8-11-20(12-9-18)25(26)27;/h3-16H,2H2,1H3;1H/q+1;/p-1/b14-13+;