6-bromanyl-2-(4-butylphenyl)-N-cyclohexyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-butylphenyl)-N-cyclohexyl-quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-butylphenyl)-N-cyclohexyl-quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-butylphenyl)-N-cyclohexyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-butylphenyl)-N-cyclohexylquinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-butylphenyl)-N-cyclohexyl-cinchoninamide Formula: C26H29BrN2O MolecularWeight: 465.42526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4CCCCC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4CCCCC4

InChI

InChI=1S/C26H29BrN2O/c1-2-3-7-18-10-12-19(13-11-18)25-17-23(22-16-20(27)14-15-24(22)29-25)26(30)28-21-8-5-4-6-9-21/h10-17,21H,2-9H2,1H3,(H,28,30)