N4-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoranyl-3-iodanyl-phenyl)-6-iodanyl-benzene-1,4-dicarboxamide

Systemtic Name: N4-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoranyl-3-iodanyl-phenyl)-6-iodanyl-benzene-1,4-dicarboxamide Openeye Name: N4-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoro-3-iodo-phenyl)-6-iodo-terephthalamide CAS Name: N4-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoro-3-iodophenyl)-6-iodobenzene-1,4-dicarboxamide IUPAC Name: 4-N-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoro-3-iodophenyl)-6-iodobenzene-1,4-dicarboxamide Traditional Name: N'-[3-(benzamidomethyl)cyclohexyl]-2-(2-fluoro-3-iodo-phenyl)-6-iodo-terephthalamide Formula: C28H26FI2N3O3 MolecularWeight: 725.331683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)NC(=O)C2=CC(=C(C(=C2)C3=C(C(=CC=C3)I)F)C(=O)N)I)CNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(CC(C1)NC(=O)C2=CC(=C(C(=C2)C3=C(C(=CC=C3)I)F)C(=O)N)I)CNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26FI2N3O3/c29-25-20(10-5-11-22(25)30)21-13-18(14-23(31)24(21)26(32)35)28(37)34-19-9-4-6-16(12-19)15-33-27(36)17-7-2-1-3-8-17/h1-3,5,7-8,10-11,13-14,16,19H,4,6,9,12,15H2,(H2,32,35)(H,33,36)(H,34,37)