2-(3-methylpiperidin-1-yl)-N-pentyl-quinoline-4-carboxamide

Systemtic Name: 2-(3-methylpiperidin-1-yl)-N-pentyl-quinoline-4-carboxamide Openeye Name: 2-(3-methyl-1-piperidyl)-N-pentyl-quinoline-4-carboxamide CAS Name: 2-(3-methyl-1-piperidinyl)-N-pentyl-4-quinolinecarboxamide IUPAC Name: 2-(3-methylpiperidin-1-yl)-N-pentylquinoline-4-carboxamide Traditional Name: N-amyl-2-(3-methylpiperidino)cinchoninamide Formula: C21H29N3O MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCCC(C3)C

Isomeric SMILES

CCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCCC(C3)C

InChI

InChI=1S/C21H29N3O/c1-3-4-7-12-22-21(25)18-14-20(24-13-8-9-16(2)15-24)23-19-11-6-5-10-17(18)19/h5-6,10-11,14,16H,3-4,7-9,12-13,15H2,1-2H3,(H,22,25)