(2E)-2-[(2Z,4E)-3-iodanyl-5-(1,3,3-trimethylindol-1-ium-2-yl)penta-2,4-dienylidene]-1,3,3-trimethyl-indole tetrafluoroborate

Systemtic Name: (2E)-2-[(2Z,4E)-3-iodanyl-5-(1,3,3-trimethylindol-1-ium-2-yl)penta-2,4-dienylidene]-1,3,3-trimethyl-indole tetrafluoroborate Openeye Name: 2-[(1E,3Z,5E)-3-iodo-5-(1,3,3-trimethylindolin-2-ylidene)penta-1,3-dienyl]-1,3,3-trimethyl-indol-1-ium tetrafluoroborate CAS Name: (2E)-2-[(2Z,4E)-3-iodo-5-(1,3,3-trimethyl-2-indol-1-iumyl)penta-2,4-dienylidene]-1,3,3-trimethylindole tetrafluoroborate IUPAC Name: (2E)-2-[(2Z,4E)-3-iodo-5-(1,3,3-trimethylindol-1-ium-2-yl)penta-2,4-dienylidene]-1,3,3-trimethylindole tetrafluoroborate Traditional Name: 2-[(1E,3Z,5E)-3-iodo-5-(1,3,3-trimethylindolin-2-ylidene)penta-1,3-dienyl]-1,3,3-trimethyl-indol-1-ium tetrafluoroborate Formula: C27H30BF4IN2 MolecularWeight: 596.249583

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1(C2=CC=CC=C2[N+](=C1C=CC(=CC=C3C(C4=CC=CC=C4N3C)(C)C)I)C)C

Isomeric SMILES

[B-](F)(F)(F)F.CC1(C2=CC=CC=C2[N+](=C1/C=C/C(=C/C=C/3\C(C4=CC=CC=C4N3C)(C)C)/I)C)C

InChI

InChI=1S/C27H30IN2.BF4/c1-26(2)20-11-7-9-13-22(20)29(5)24(26)17-15-19(28)16-18-25-27(3,4)21-12-8-10-14-23(21)30(25)6;2-1(3,4)5/h7-18H,1-6H3;/q+1;-1