N-[3-[4-(5-cyano-1H-indol-3-yl)piperidin-1-yl]propyl]-6-methoxy-quinoline-4-carboxamide

Systemtic Name: N-[3-[4-(5-cyano-1H-indol-3-yl)piperidin-1-yl]propyl]-6-methoxy-quinoline-4-carboxamide Openeye Name: N-[3-[4-(5-cyano-1H-indol-3-yl)-1-piperidyl]propyl]-6-methoxy-quinoline-4-carboxamide CAS Name: N-[3-[4-(5-cyano-1H-indol-3-yl)-1-piperidinyl]propyl]-6-methoxy-4-quinolinecarboxamide IUPAC Name: N-[3-[4-(5-cyano-1H-indol-3-yl)piperidin-1-yl]propyl]-6-methoxyquinoline-4-carboxamide Traditional Name: N-[3-[4-(5-cyano-1H-indol-3-yl)piperidino]propyl]-6-methoxy-cinchoninamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(=O)NCCCN3CCC(CC3)C4=CNC5=C4C=C(C=C5)C#N

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(=O)NCCCN3CCC(CC3)C4=CNC5=C4C=C(C=C5)C#N

InChI

InChI=1S/C28H29N5O2/c1-35-21-4-6-26-24(16-21)22(7-11-30-26)28(34)31-10-2-12-33-13-8-20(9-14-33)25-18-32-27-5-3-19(17-29)15-23(25)27/h3-7,11,15-16,18,20,32H,2,8-10,12-14H2,1H3,(H,31,34)