6-bromanyl-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-tert-butylphenyl)-N-[2-(4-methoxyphenyl)ethyl]cinchoninamide Formula: C29H29BrN2O2 MolecularWeight: 517.45676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCCC4=CC=C(C=C4)OC

InChI

InChI=1S/C29H29BrN2O2/c1-29(2,3)21-9-7-20(8-10-21)27-18-25(24-17-22(30)11-14-26(24)32-27)28(33)31-16-15-19-5-12-23(34-4)13-6-19/h5-14,17-18H,15-16H2,1-4H3,(H,31,33)