2-(5-bromanyl-1H-indol-3-yl)-N-(4-piperidin-3-ylbutyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-bromanyl-1H-indol-3-yl)-N-(4-piperidin-3-ylbutyl)quinoline-4-carboxamide Openeye Name: 2-(5-bromo-1H-indol-3-yl)-N-[4-(3-piperidyl)butyl]quinoline-4-carboxamide CAS Name: 2-(5-bromo-1H-indol-3-yl)-N-[4-(3-piperidinyl)butyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-bromo-1H-indol-3-yl)-N-(4-piperidin-3-ylbutyl)quinoline-4-carboxamide Traditional Name: 2-(5-bromo-1H-indol-3-yl)-N-[4-(3-piperidyl)butyl]cinchoninamide Formula: C27H29BrN4O MolecularWeight: 505.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)CCCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CNC5=C4C=C(C=C5)Br

Isomeric SMILES

C1CC(CNC1)CCCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CNC5=C4C=C(C=C5)Br

InChI

InChI=1S/C27H29BrN4O/c28-19-10-11-24-21(14-19)23(17-31-24)26-15-22(20-8-1-2-9-25(20)32-26)27(33)30-13-4-3-6-18-7-5-12-29-16-18/h1-2,8-11,14-15,17-18,29,31H,3-7,12-13,16H2,(H,30,33)