N-(3,3-dimethylbutan-2-yl)-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]quinoline-4-carboxamide

Systemtic Name: N-(3,3-dimethylbutan-2-yl)-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-phenyl-3-[[4-(1-piperidyl)-1-piperidyl]methyl]-N-(1,2,2-trimethylpropyl)quinoline-4-carboxamide CAS Name: N-(3,3-dimethylbutan-2-yl)-2-phenyl-3-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-4-quinolinecarboxamide IUPAC Name: N-(3,3-dimethylbutan-2-yl)-2-phenyl-3-[(4-piperidin-1-ylpiperidin-1-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-phenyl-3-[(4-piperidinopiperidino)methyl]-N-(1,2,2-trimethylpropyl)cinchoninamide Formula: C33H44N4O MolecularWeight: 512.72866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)CN4CCC(CC4)N5CCCCC5

Isomeric SMILES

CC(C(C)(C)C)NC(=O)C1=C(C(=NC2=CC=CC=C21)C3=CC=CC=C3)CN4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C33H44N4O/c1-24(33(2,3)4)34-32(38)30-27-15-9-10-16-29(27)35-31(25-13-7-5-8-14-25)28(30)23-36-21-17-26(18-22-36)37-19-11-6-12-20-37/h5,7-10,13-16,24,26H,6,11-12,17-23H2,1-4H3,(H,34,38)