1-butyl-2-piperidin-1-yl-3-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]-9H-fluorene-9-carboxamide

Systemtic Name: 1-butyl-2-piperidin-1-yl-3-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]-9H-fluorene-9-carboxamide Openeye Name: 1-butyl-2-(1-piperidyl)-3-[(2,3,5-triiodobenzoyl)amino]-9H-fluorene-9-carboxamide CAS Name: 1-butyl-3-[[oxo-(2,3,5-triiodophenyl)methyl]amino]-2-(1-piperidinyl)-9H-fluorene-9-carboxamide IUPAC Name: 1-butyl-2-piperidin-1-yl-3-[(2,3,5-triiodobenzoyl)amino]-9H-fluorene-9-carboxamide Traditional Name: 1-butyl-2-piperidino-3-[(2,3,5-triiodobenzoyl)amino]-9H-fluorene-9-carboxamide Formula: C30H30I3N3O2 MolecularWeight: 845.29151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(C3=CC=CC=C3C2=CC(=C1N4CCCCC4)NC(=O)C5=CC(=CC(=C5I)I)I)C(=O)N

Isomeric SMILES

CCCCC1=C2C(C3=CC=CC=C3C2=CC(=C1N4CCCCC4)NC(=O)C5=CC(=CC(=C5I)I)I)C(=O)N

InChI

InChI=1S/C30H30I3N3O2/c1-2-3-9-20-25-21(18-10-5-6-11-19(18)26(25)29(34)37)16-24(28(20)36-12-7-4-8-13-36)35-30(38)22-14-17(31)15-23(32)27(22)33/h5-6,10-11,14-16,26H,2-4,7-9,12-13H2,1H3,(H2,34,37)(H,35,38)