N-(4-bromanyl-2-ethyl-phenyl)-2-(4-chlorophenyl)-6-ethyl-quinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-ethyl-phenyl)-2-(4-chlorophenyl)-6-ethyl-quinoline-4-carboxamide Openeye Name: N-(4-bromo-2-ethyl-phenyl)-2-(4-chlorophenyl)-6-ethyl-quinoline-4-carboxamide CAS Name: N-(4-bromo-2-ethylphenyl)-2-(4-chlorophenyl)-6-ethyl-4-quinolinecarboxamide IUPAC Name: N-(4-bromo-2-ethylphenyl)-2-(4-chlorophenyl)-6-ethylquinoline-4-carboxamide Traditional Name: N-(4-bromo-2-ethyl-phenyl)-2-(4-chlorophenyl)-6-ethyl-cinchoninamide Formula: C26H22BrClN2O MolecularWeight: 493.82268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=C(C=C3)Br)CC)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=C(C=C3)Br)CC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H22BrClN2O/c1-3-16-5-11-24-21(13-16)22(15-25(29-24)18-6-9-20(28)10-7-18)26(31)30-23-12-8-19(27)14-17(23)4-2/h5-15H,3-4H2,1-2H3,(H,30,31)