(3E)-2-iodanyl-5,6-bis(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole

Systemtic Name: (3E)-2-iodanyl-5,6-bis(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole Openeye Name: (1E)-5,6-dibenzyl-1-benzylidene-2-iodo-isoindoline CAS Name: (3E)-2-iodo-5,6-bis(phenylmethyl)-3-(phenylmethylene)-1H-isoindole IUPAC Name: (3E)-5,6-dibenzyl-3-benzylidene-2-iodo-1H-isoindole Traditional Name: (1E)-1-benzal-5,6-dibenzyl-2-iodo-isoindoline Formula: C29H24IN MolecularWeight: 513.41203

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C(C=C2C(=CC3=CC=CC=C3)N1I)CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C2=CC(=C(C=C2/C(=C\C3=CC=CC=C3)/N1I)CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H24IN/c30-31-21-27-19-25(16-22-10-4-1-5-11-22)26(17-23-12-6-2-7-13-23)20-28(27)29(31)18-24-14-8-3-9-15-24/h1-15,18-20H,16-17,21H2/b29-18+