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

Systemtic Name: N-[3-(4-chloranyl-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(4-chloro-2-cyclohexyl-phenoxy)-5-nitro-phenyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C35H30ClN3O5 MolecularWeight: 608.0828

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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=C(C=C(C=C5)Cl)C6CCCCC6)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)OC5=C(C=C(C=C5)Cl)C6CCCCC6)[N+](=O)[O-]

InChI

InChI=1S/C35H30ClN3O5/c1-43-27-14-11-23(12-15-27)33-21-31(29-9-5-6-10-32(29)38-33)35(40)37-25-18-26(39(41)42)20-28(19-25)44-34-16-13-24(36)17-30(34)22-7-3-2-4-8-22/h5-6,9-22H,2-4,7-8H2,1H3,(H,37,40)