6-bromanyl-2-(4-ethylphenyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-ethylphenyl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-ethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-ethylphenyl)-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-ethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-ethylphenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]cinchoninamide Formula: C29H26BrN3O2 MolecularWeight: 528.43964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N5CCCC5

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC=C(C=C4)C(=O)N5CCCC5

InChI

InChI=1S/C29H26BrN3O2/c1-2-19-5-7-20(8-6-19)27-18-25(24-17-22(30)11-14-26(24)32-27)28(34)31-23-12-9-21(10-13-23)29(35)33-15-3-4-16-33/h5-14,17-18H,2-4,15-16H2,1H3,(H,31,34)