N-[3-(4-bromanylphenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-(4-bromanylphenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3-(4-bromophenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3-(4-bromophenoxy)-5-nitrophenyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(4-bromophenoxy)-5-nitrophenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(4-bromophenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C29H20BrN3O5 MolecularWeight: 570.3902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)Br)[N+](=O)[O-]

InChI

InChI=1S/C29H20BrN3O5/c1-37-22-10-6-18(7-11-22)28-17-26(25-4-2-3-5-27(25)32-28)29(34)31-20-14-21(33(35)36)16-24(15-20)38-23-12-8-19(30)9-13-23/h2-17H,1H3,(H,31,34)