N-[3-(4-chloranyl-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[3-(4-chloranyl-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-phenyl-cinchoninamide Formula: C34H28ClN3O4 MolecularWeight: 578.05682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC(=CC(=C3)[N+](=O)[O-])NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC(=CC(=C3)[N+](=O)[O-])NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C34H28ClN3O4/c35-24-15-16-33(29(17-24)22-9-3-1-4-10-22)42-27-19-25(18-26(20-27)38(40)41)36-34(39)30-21-32(23-11-5-2-6-12-23)37-31-14-8-7-13-28(30)31/h2,5-8,11-22H,1,3-4,9-10H2,(H,36,39)