2-(5-bromanyl-1H-indol-3-yl)-6-iodanyl-N-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-bromanyl-1H-indol-3-yl)-6-iodanyl-N-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(5-bromo-1H-indol-3-yl)-6-iodo-N-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(5-bromo-1H-indol-3-yl)-6-iodo-N-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 2-(5-bromo-1H-indol-3-yl)-6-iodo-N-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(5-bromo-1H-indol-3-yl)-6-iodo-N-(4-methoxyphenyl)cinchoninamide Formula: C25H17BrIN3O2 MolecularWeight: 598.22985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)I)C4=CNC5=C4C=C(C=C5)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)I)C4=CNC5=C4C=C(C=C5)Br

InChI

InChI=1S/C25H17BrIN3O2/c1-32-17-6-4-16(5-7-17)29-25(31)20-12-24(30-23-9-3-15(27)11-19(20)23)21-13-28-22-8-2-14(26)10-18(21)22/h2-13,28H,1H3,(H,29,31)