2-(5-chloranyl-1H-indol-3-yl)-N-(3-methoxypropyl)-6-(3-piperidin-1-ylprop-1-ynyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranyl-1H-indol-3-yl)-N-(3-methoxypropyl)-6-(3-piperidin-1-ylprop-1-ynyl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-1H-indol-3-yl)-N-(3-methoxypropyl)-6-[3-(1-piperidyl)prop-1-ynyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-1H-indol-3-yl)-N-(3-methoxypropyl)-6-[3-(1-piperidinyl)prop-1-ynyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chloro-1H-indol-3-yl)-N-(3-methoxypropyl)-6-(3-piperidin-1-ylprop-1-ynyl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-1H-indol-3-yl)-N-(3-methoxypropyl)-6-(3-piperidinoprop-1-ynyl)cinchoninamide Formula: C30H31ClN4O2 MolecularWeight: 515.04574

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)C#CCN3CCCCC3)C4=CNC5=C4C=C(C=C5)Cl

Isomeric SMILES

COCCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)C#CCN3CCCCC3)C4=CNC5=C4C=C(C=C5)Cl

InChI

InChI=1S/C30H31ClN4O2/c1-37-16-6-12-32-30(36)25-19-29(26-20-33-27-11-9-22(31)18-24(26)27)34-28-10-8-21(17-23(25)28)7-5-15-35-13-3-2-4-14-35/h8-11,17-20,33H,2-4,6,12-16H2,1H3,(H,32,36)