2-methyl-3,5-bis[(E)-2-phenylethenyl]-1,2-oxazol-2-ium iodide

Systemtic Name: 2-methyl-3,5-bis[(E)-2-phenylethenyl]-1,2-oxazol-2-ium iodide Openeye Name: 2-methyl-3,5-bis[(E)-styryl]isoxazol-2-ium iodide CAS Name: 2-methyl-3,5-bis[(E)-2-phenylethenyl]isoxazol-2-ium iodide IUPAC Name: 2-methyl-3,5-bis[(E)-2-phenylethenyl]-1,2-oxazol-2-ium iodide Traditional Name: 2-methyl-3,5-bis[(E)-styryl]isoxazol-2-ium iodide Formula: C20H18INO MolecularWeight: 415.26749

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(O1)C=CC2=CC=CC=C2)C=CC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=C(C=C(O1)/C=C/C2=CC=CC=C2)/C=C/C3=CC=CC=C3.[I-]

InChI

InChI=1S/C20H18NO.HI/c1-21-19(14-12-17-8-4-2-5-9-17)16-20(22-21)15-13-18-10-6-3-7-11-18;/h2-16H,1H3;1H/q+1;/p-1/b14-12+,15-13+;