6-bromanyl-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[1-(4-tert-butylphenyl)ethyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C29H29BrN2O2 MolecularWeight: 517.45676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H29BrN2O2/c1-18(19-6-10-21(11-7-19)29(2,3)4)31-28(33)25-17-27(20-8-13-23(34-5)14-9-20)32-26-15-12-22(30)16-24(25)26/h6-18H,1-5H3,(H,31,33)